SCHEMBL2906006

SCHEMBL2906006

CN1CCN(Cc2ccc(C(N)=O)cc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.68
LMNA P02545 1/20 0.62
HRH3 Q9Y5N1 2/20 0.60
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
CHKA P35790 4/20 0.57
MAP3K11 Q16584 1/20 0.57
MC4R P32245 1/20 0.56
GAA P10253 1/20 0.56
CA2 P00918 2/20 0.55
NCF1 P14598 1/20 0.55
PRMT6 Q96LA8 1/20 0.55
BTK Q06187 1/20 0.53
HDAC3 O15379 1/20 0.53
HDAC4 P56524 1/20 0.53
HDAC1 Q13547 1/20 0.53
HDAC7 Q8WUI4 1/20 0.53
HDAC2 Q92769 1/20 0.53
HDAC10 Q969S8 1/20 0.53
HDAC11 Q96DB2 1/20 0.53

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
SCHEMBL2776747 0.87 ALDH1A1 (0.59) HDAC6LMNAHRH3MEN1KMT2A
SCHEMBL28061494 0.86 HDAC6 (0.71) HDAC6LMNAHRH3CHKAMC4R
SCHEMBL4699834 0.85 SIGMAR1 (0.50) HDAC6HRH3MEN1KMT2AMAP3K11
SCHEMBL16356429 0.85 HDAC6 (0.69) HDAC6LMNAHRH3MEN1KMT2A
SCHEMBL1174 0.85 HDAC6 (0.69) HDAC6LMNAHRH3CHKAMC4R
SCHEMBL12966235 0.85 HDAC6 (0.69) HDAC6LMNAHRH3CHKAMC4R
SCHEMBL65179 0.85 HDAC6 (0.69) HDAC6LMNAHRH3MEN1KMT2A
SCHEMBL1482327 0.85 HDAC6 (0.69) HDAC6LMNAHRH3CHKAMC4R
SCHEMBL5839834 0.85 HDAC6 (0.69) HDAC6LMNAHRH3CHKAMC4R
SCHEMBL2907506 0.84 HDAC1 (0.65) HDAC6HRH3MEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120136781-A ROR 1-targeted inhibitor and synthesis method and application thereof 北京大学 2025-06-13 CN claimed
US-20220306588-A1 BEZIMIDAZOLE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS MERCK PATENT GMBH (DE) 2022-09-29 US claimed
US-11453647-B2 Benzimidazole derivatives as adenosine receptor antagonists MERCK PATENT GMBH (DE) 2022-09-27 US claimed
CN-110559299-A composition containing pyridyl pyrimidinamine compound and application thereof 黄泳华 2019-12-13 CN claimed
CN-106854198-B A kind of preparation method of Imatinib 湖南华腾医药有限公司 2019-11-05 CN claimed
CN-103980230-B One prepares the method for 4-(4-methylpiperazine-l-methyl) benzamide NORTHWEST UNIVERSITY (CN) 2016-02-17 CN claimed
CN-103980230-A Method for preparing 4-(4-methyl piperazine-1-methyl)-benzoyl amide UNIV NORTHWESTERN 2014-08-13 CN claimed
US-20120122857-A1 HETEROBICYCLIC CARBOXAMIDES AS INHIBITORS FOR KINASES NOVARTIS AG (CH) 2012-05-17 US claimed
WO-2010014022-A1 A PROCESS FOR THE PREPARATION OF IMATINIB TEMAPHARM SP. Z O.O. (PL) 2010-02-04 WO claimed
US-20100029626-A1 Cyclic sulfones useful as mitochondrial sodium-calcium exchangers NOVARTIS AG (CH) 2010-02-04 US claimed
US-7579356-B2 Thia-tetraazaacenaphthylene kinase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2009-08-25 US claimed
EP-1996558-A1 HETEROBICYCLIC CARBOXAMIDES AS INHIBITORS FOR KINASES Novartis AG (CH) 2008-12-03 EP claimed
US-20080108611-A1 SUBSTITUTED THIENOPYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-05-08 US claimed
US-20070265264-A1 5-(3-chloro-4-fluoro-phenyl)-4-oxo-4,5-dihydro-3H-1-thia-3,5,6,8-tetraaza-acenaphthylene-2-carboxylic acid (3,4-dimethoxy-phenyl)-amide JANSSEN PHARMACEUTICA, N.V. (BE) 2007-11-15 US claimed
WO-2007104538-A1 HETEROBICYCLIC CARBOXAMIDES AS INHIBITORS FOR KINASES NOVARTIS AG (CH) 2007-09-20 WO claimed
WO-2007084815-A2 SUBSTITUTED THIENOPYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-07-26 WO claimed
WO-2005065074-A2 PROTECTION OF TISSUES AND CELLS FROM CYTOTOXIC EFFECTS OF IONIZING RADIATION BY ABL INHIBITORS TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2005-07-21 WO claimed
CN-120136781-A ROR 1-targeted inhibitor and synthesis method and application thereof 北京大学 2025-06-13 CN disclosed
WO-2004037261-A1 USE OF N-‘5-‘4-(4-METHYLPIPERAZIOMETHYL)-BENZOYLAMIDO!-2-METHYLPHENYL!-4-(3-PYRIDYL)2-PYRIDINE-AMINE FOR THE TREATMENT OF PULMONARY HYPERTENSION THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2004-05-06 WO disclosed
EP-1392313-A1 COMBINATION COMPRISING N- 5- 4-(4-METHYL-PIPERAZINO-METHYL)-BENZOYLAMIDO]-2-METHYLPHENYL -4-(3-PYRIDYL)-2PYRIMIDINE-AMINE AND A CHEMOTHERAPEUTIC AGENT Novartis AG (CH) 2004-03-03 EP 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-20100029626-A1 Cyclic sulfones useful as mitochondrial sodium-calcium exchangers SLC8B1, MCU, GLS HDAC6 2385/4885LMNA 2752/4885HRH3 4557/4885
US-20220306588-A1 BEZIMIDAZOLE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS ADORA1, ADORA2A, ADORA3 HDAC6 1370/4885LMNA 3142/4885HRH3 319/4885
US-11453647-B2 Benzimidazole derivatives as adenosine receptor antagonists ADORA1, ADORA2A, ADORA3 HDAC6 2353/4885LMNA 2856/4885HRH3 181/4885
US-20070265264-A1 5-(3-chloro-4-fluoro-phenyl)-4-oxo-4,5-dihydro-3H-1-thia-3,5,6,8-tetraaza-acenaphthylene-2-carboxylic acid (3,4-dimethoxy-phenyl)-amide ADK, MAP3K9, MAP4K5 HDAC6 2295/4885LMNA 3244/4885HRH3 1681/4885
US-20080108611-A1 SUBSTITUTED THIENOPYRIMIDINE KINASE INHIBITORS MAP4K2, MAP3K6, MAP3K2 HDAC6 2550/4885LMNA 4421/4885HRH3 1921/4885
US-20120122857-A1 HETEROBICYCLIC CARBOXAMIDES AS INHIBITORS FOR KINASES MAP3K20, PHKG1, PHKG2 HDAC6 601/4885LMNA 2458/4885HRH3 1075/4885

“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.