SCHEMBL643388

SCHEMBL643388

CC1(N)CCCc2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.66
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
AKR1B1 P15121 1/20 0.44
MAOB P27338 1/20 0.43
SIGMAR1 Q99720 4/20 0.42
EBP Q15125 1/20 0.42
HTR2A P28223 2/20 0.41
TSHR P16473 2/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
DRD2 P14416 1/20 0.41
NFKB1 P19838 1/20 0.41
HTR2C P28335 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTR2B P41595 1/20 0.41
MTOR P42345 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1273553 1.00 KDM1A (0.66) KDM1AMEN1KMT2AAKR1B1MAOB
SCHEMBL31278806 0.88 KDM1A (0.55) KDM1AMEN1KMT2AMAOBSIGMAR1
SCHEMBL7441079 0.88 KDM1A (0.55) KDM1AMEN1KMT2AMAOBSIGMAR1
SCHEMBL18088758 0.88 KDM1A (0.55) KDM1AMEN1KMT2AMAOBSIGMAR1
SCHEMBL2464182 0.88 KDM1A (0.55) KDM1AMEN1KMT2AMAOBSIGMAR1
Hydrochloric Acid SCHEMBL26916642 0.86 KDM1A (0.53) KDM1AMEN1KMT2AMAOBSIGMAR1
Propane SCHEMBL27768603 0.82 KDM1A (0.50) KDM1AMEN1KMT2AMAOBSIGMAR1
SCHEMBL17988045 0.79 KDM1A (1.00) KDM1AMEN1KMT2AAKR1B1MAOB
SCHEMBL578812 0.79 KDM1A (0.59) KDM1AMEN1KMT2AAKR1B1MAOB
SCHEMBL1101137 0.79 KDM1A (0.59) KDM1AMEN1KMT2AAKR1B1MAOB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11931366-B2 Compositions and methods of use thereof for treatment of proteinopathies WASHINGTON UNIVERSITY (US) 2024-03-19 US disclosed
US-11878979-B2 Substituted imidazo[1,2-b]pyridazines, substituted imidazo[1,5-b]pyridazines, related compounds, and their use in the treatment of medical disorders Bial—R&D Investments, S.A. (PT) 2024-01-23 US disclosed
US-20230174492-A1 SUBSTITUTED CONDENSED AZINES AS ANTHELMINTIC COMPOUNDS ELANCO ANIMAL HEALTH GMBH (DE) 2023-06-08 US disclosed
EP-3215510-B1 SUBSTITUTED IMIDAZO[1,5-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL R&D INVEST S A (PT) 2023-06-07 EP disclosed
US-20230141809-A1 QUINOLINE DERIVATIVES ELANCO ANIMAL HEALTH GMBH (DE) 2023-05-11 US disclosed
US-11572357-B2 Quinoline derivatives BAYER ANIMAL HEALTH GMBH (DE) 2023-02-07 US disclosed
US-11400095-B2 Substituted imidazo[1,5-a]pyrimidines and their use in the treatment of medical disorders Bial—R&D Investments, S.A. (PT) 2022-08-02 US disclosed
CN-109311902-B Substituted imidazo [1,2-b ] pyridazines, imidazo [1,5-b ] pyridazines, related compounds, and uses thereof BIAL研发投资股份有限公司 2022-07-15 CN disclosed
US-20220185814-A1 SUBSTITUTED IMIDAZO[1,2-b]PYRIDAZINES, SUBSTITUTED IMIDAZO[1,5-b]PYRIDAZINES, RELATED COMPOUNDS, AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL - R&D INVESTMENTS, S.A. (PT) 2022-06-16 US disclosed
US-11351173-B2 Substituted pyrrolo[1,2-a]pyrimidines and their use in the treatment of medical disorders Bial—R&D Investments, S.A. (PT) 2022-06-07 US disclosed
US-20150336928-A1 Heterocyclic Compounds And Methods Of Use Thereof SUNOVION PHARMACEUTICALS INC. 2015-11-26 US disclosed
US-20150336928-A1 Heterocyclic Compounds And Methods Of Use Thereof SUNOVION PHARMACEUTICALS INC. 2015-11-26 US disclosed
US-20150336928-A1 Heterocyclic Compounds And Methods Of Use Thereof SUNOVION PHARMACEUTICALS INC. 2015-11-26 US disclosed
US-20140288023-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTICS DELIVERY CERULEAN PHARMA INC. (US) 2014-09-25 US disclosed
CN-102245562-B Process for the synthesis of amino-methyltetralin derivatives HOFFMANN LA ROCHE 2014-08-13 CN disclosed
WO-2014106238-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF FANG, QUN, KEVIN (US) 2014-07-03 WO disclosed
US-8119842-B2 Process for synthesis of amino-methyl tetralin derivatives Roche Palo Alto LLP (US) 2012-02-21 US disclosed
CN-102245562-A Process for the synthesis of amino-methyltetralin derivatives HOFFMANN LA ROCHE 2011-11-16 CN disclosed
US-7737167-B2 2-amino benzimidazole derivatives and their use as modulators of small-conductance calcium-activated potassium channels NEUROSEARCH A/S (DK) 2010-06-15 US disclosed
US-20100009970-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES COMBINATORX (SINGAPORE) PTE. LTD. (SG) 2010-01-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11351173-B2 Substituted pyrrolo[1,2-a]pyrimidines and their use in the treatment of medical disorders TYMP, PARK7, PNP KDM1A 846/4885MEN1 3196/4885KMT2A 771/4885
US-20100009970-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES HTR1A, HTR3B, HTR3A KDM1A 491/4885MEN1 3638/4885KMT2A 1108/4885
US-20150336928-A1 Heterocyclic Compounds And Methods Of Use Thereof GRIN2C, COMT, NLN KDM1A 3995/4885MEN1 2159/4885KMT2A 2037/4885
US-11400095-B2 Substituted imidazo[1,5-a]pyrimidines and their use in the treatment of medical disorders GBA1, GAA, SNCA KDM1A 889/4885MEN1 2957/4885KMT2A 612/4885
US-11878979-B2 Substituted imidazo[1,2-b]pyridazines, substituted imidazo[1,5-b]pyridazines, related compounds, and their use in the treatment of medical disorders GBA1, GBA2, GALC KDM1A 410/4885MEN1 1026/4885KMT2A 303/4885
US-20220185814-A1 SUBSTITUTED IMIDAZO[1,2-b]PYRIDAZINES, SUBSTITUTED IMIDAZO[1,5-b]PYRIDAZINES, RELATED COMPOUNDS, AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GBA2, GALC KDM1A 410/4885MEN1 1026/4885KMT2A 303/4885
US-20230141809-A1 QUINOLINE DERIVATIVES RECQL, NQO2, QTRT2 KDM1A 905/4885MEN1 654/4885KMT2A 1122/4885
US-11931366-B2 Compositions and methods of use thereof for treatment of proteinopathies SERPINA2, FABP1, TTR KDM1A 4169/4885MEN1 3457/4885KMT2A 4403/4885
US-20140288023-A1 CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTICS DELIVERY DDOST, DSC1, SI KDM1A 4358/4885MEN1 4082/4885KMT2A 4639/4885
US-11572357-B2 Quinoline derivatives RECQL, NQO2, QTRT2 KDM1A 914/4885MEN1 683/4885KMT2A 1142/4885
US-20230174492-A1 SUBSTITUTED CONDENSED AZINES AS ANTHELMINTIC COMPOUNDS H1-5, H1-10, H1-0 KDM1A 417/4885MEN1 543/4885KMT2A 812/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.