SCHEMBL16021069

SCHEMBL16021069

CNC1CCC(N[C@H]2C[C@@H]2c2ccccc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 19/20 1.00
MAOB P27338 8/20 1.00
MAOA P21397 3/20 0.71
KDM1B Q8NB78 1/20 0.71
RCOR1 Q9UKL0 1/20 0.71
CISD1 Q9NZ45 1/20 0.66
SLC6A2 P23975 1/20 0.66
HTR1B P28222 1/20 0.66
HTR2A P28223 1/20 0.66
SLC6A4 P31645 1/20 0.66

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
SCHEMBL14880427 1.00 KDM1A (1.00) KDM1AMAOBMAOAKDM1BRCOR1
SCHEMBL18214503 1.00 KDM1A (1.00) KDM1AMAOBMAOAKDM1BRCOR1
SCHEMBL19409816 1.00 KDM1A (1.00) KDM1AMAOBMAOAKDM1BRCOR1
SCHEMBL14880428 1.00 KDM1A (1.00) KDM1AMAOBMAOAKDM1BRCOR1
SCHEMBL19422223 0.86 KDM1A (0.76) KDM1AMAOBMAOAKDM1BRCOR1
SCHEMBL900481 0.84 KDM1A (0.72) KDM1AMAOBMAOAKDM1BRCOR1
Iadademstat SCHEMBL19428614 0.83 KDM1A (1.00) KDM1AMAOBMAOAKDM1BRCOR1
Iadademstat SCHEMBL16010213 0.83 KDM1A (1.00) KDM1AMAOBMAOAKDM1BRCOR1
Iadademstat SCHEMBL20260493 0.83 KDM1A (1.00) KDM1AMAOBMAOAKDM1BRCOR1
Iadademstat SCHEMBL19409823 0.83 KDM1A (1.00) KDM1AMAOBMAOAKDM1BRCOR1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190256929-A1 PHARMACODYNAMIC BIOMARKERS FOR PERSONALIZED CANCER CARE USING EPIGENETIC MODIFYING AGENTS ORYZON GENOMICS SA (ES) 2019-08-22 US disclosed
US-20190153538-A1 GENE EXPRESSION BIOMARKERS FOR PERSONALIZED CANCER CARE TO EPIGENETIC MODIFYING AGENTS ORYZON GENOMICS SA (ES) 2019-05-23 US disclosed
US-10265279-B2 Combinations of LSD1 inhibitors for use in the treatment of solid tumors ORYZON GENOMICS, S.A. (ES) 2019-04-23 US disclosed
US-20180079709-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS ORYZON GENOMICS SA (ES) 2018-03-22 US disclosed
US-20170281567-A1 COMBINATIONS OF LSD1 INHIBITORS FOR USE IN THE TREATMENT OF SOLID TUMORS HOFFMANN-LA ROCHE INC. (US) 2017-10-05 US disclosed
WO-2017157825-A1 COMBINATIONS OF LSD1 INHIBITORS FOR USE IN THE TREATMENT OF SOLID TUMORS F. HOFFMANN-LA ROCHE AG (CH) 2017-09-21 WO disclosed
US-9670136-B2 (Hetero)aryl cyclopropylamine compounds as LSD1 inhibitors ORYZON GENOMICS S.A. (ES) 2017-06-06 US disclosed
WO-2017060319-A1 GENE EXPRESSION BIOMARKERS FOR PERSONALIZED CANCER CARE TO EPIGENETIC MODIFYING AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2017-04-13 WO disclosed
US-20160368857-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS ORYZON GENOMICS SA (ES) 2016-12-22 US disclosed
US-9469597-B2 (Hetero)aryl cyclopropylamine compounds as LSD1 inhibitors ORYZON GENOMICS S.A. (ES) 2016-10-18 US disclosed
US-20150119396-A9 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS ORYZON GENOMICS S.A. (ES) 2015-04-30 US disclosed
US-20140256729-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS ORYZON GENOMICS SA (ES) 2014-09-11 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 (6 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-20160368857-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS KDM1B, KDM1A, KDM2A KDM1A 2/4885MAOB 147/4885MAOA 135/4885
US-20150119396-A9 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS KDM1A, KDM1B, KDM3B KDM1A 1/4885MAOB 186/4885MAOA 175/4885
US-10265279-B2 Combinations of LSD1 inhibitors for use in the treatment of solid tumors KDM1B, DOT1L, KDM1A KDM1A 3/4885MAOB 917/4885MAOA 696/4885
US-20140256729-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS KDM1A, KDM1B, KDM3B KDM1A 1/4885MAOB 186/4885MAOA 175/4885
US-20170281567-A1 COMBINATIONS OF LSD1 INHIBITORS FOR USE IN THE TREATMENT OF SOLID TUMORS KDM1B, DOT1L, KDM1A KDM1A 3/4885MAOB 917/4885MAOA 696/4885
US-20180079709-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS KDM1B, KDM1A, KDM2A KDM1A 2/4885MAOB 147/4885MAOA 135/4885

“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.