SCHEMBL1498780

SCHEMBL1498780

Nc1ccc(N)c(Cc2ccccc2)c1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.55
LOXL2 Q9Y4K0 2/20 0.43
MAOA P21397 2/20 0.42
MAOB P27338 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HTR2A P28223 2/20 0.41
POLB P06746 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA5A P35218 1/20 0.41
CA9 Q16790 1/20 0.41
LTB4R Q15722 1/20 0.41
AOC3 Q16853 1/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP2A6 P11509 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL2407657 0.91 CALM1 (0.46) CALM1LOXL2MAOAMAOBALDH1A1
SCHEMBL11406170 0.89 CALM1 (0.44) CALM1LOXL2MAOAMAOBALDH1A1
SCHEMBL1704793 0.89 CALM1 (0.44) CALM1HTR2ASMN1; SMN2
SCHEMBL6557214 0.87 CALM1 (0.52) CALM1LOXL2MAOAMAOBALDH1A1
SCHEMBL5426526 0.87 IDH1 (0.45) CALM1ALDH1A1LTB4RMEN1LMNA
Bromide SCHEMBL5088657 0.87 HTR2A (0.42) CALM1HTR2ASMN1; SMN2
SCHEMBL27640492 0.87 CALM1 (0.42) CALM1LOXL2MAOAMAOBALDH1A1
SCHEMBL16054535 0.87 CALM1 (0.42) CALM1LOXL2MAOAMAOBALDH1A1
Hydrochloric Acid SCHEMBL5088464 0.87 HTR2A (0.42) CALM1MAOAMAOBHTR2ASMN1; SMN2
Iodide SCHEMBL5087629 0.87 HTR2A (0.42) CALM1HTR2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111971119-B Heterogeneous catalyst for carbamate synthesis 科思创知识产权两合公司 2023-12-08 CN claimed
WO-2023228114-A1 AROMATIC AMINE DERIVATIVES COORDINATED TO METALS AS BACTERICIDAL MATERIALS AND THE PRODUCTION PROCESS THEREOF UNIVERSIDAD SANTIAGO DE CALI (CO) 2023-11-30 WO claimed
EP-3625210-A1 SILICA-BASED ZINC CATALYSTS. THEIR PREPARATION AND USE IN THE ALKOXYCARBONYLATION OF AMINES Covestro Deutschland AG (DE) 2020-03-25 EP claimed
CN-104817459-B The method for generating cyclic aliphatic two-and polyamines for Hydrogenated aromatic two-and polyamines 科思创德国股份有限公司 2019-03-08 CN claimed
WO-2018210711-A1 SILICA-BASED ZINC CATALYSTS. THEIR PREPARATION AND USE IN THE ALKOXYCARBONYLATION OF AMINES COVESTRO DEUTSCHLAND AG (DE) 2018-11-22 WO claimed
CN-105229015-A Zinc cluster compounds and their use as catalysts in the reaction of amines with dialkyl carbonates BAYER MATERIALSCIENCE AG 2016-01-06 CN claimed
CN-104817460-A Process for hydrogenating aromatic di- and polyamines BAYER MATERIALSCIENCE AG 2015-08-05 CN claimed
CN-104817459-A Process for hydrogenating aromatic di- and polyamines to cycloaliphatic di- and polyamines BAYER MATERIALSCIENCE AG 2015-08-05 CN claimed
JP-2011506452-A 2011-03-03 JP claimed
EP-2240559-A2 CYCLOALKYL PHENYLENEDIAMINES AS DEPOSIT CONTROL AGENTS FOR LUBRICANTS Chemtura Corporation (US) 2010-10-20 EP claimed
WO-2009076090-A2 CYCLOALKYL PHENYLENEDIAMINES AS DEPOSIT CONTROL AGENTS FOR LUBRICANTS CHEMTURA CORPORATION (US) 2009-06-18 WO claimed
WO-2023228114-A1 AROMATIC AMINE DERIVATIVES COORDINATED TO METALS AS BACTERICIDAL MATERIALS AND THE PRODUCTION PROCESS THEREOF UNIVERSIDAD SANTIAGO DE CALI (CO) 2023-11-30 WO disclosed
CN-113667132-B Hyperbranched polyallylamine compound, preparation method thereof, post-functionalization method and application 华南理工大学 2022-05-24 CN disclosed
CN-113667132-A Hyperbranched polyallylamine compound, preparation method thereof, post-functionalization method and application 华南理工大学 2021-11-19 CN disclosed
US-9278906-B2 Process for hydrogenating aromatic di- and polyamines to cycloaliphatic di- and polyamines BAYER MATERIALSCIENCE AG (DE) 2016-03-08 US disclosed
CN-105229015-A Zinc cluster compounds and their use as catalysts in the reaction of amines with dialkyl carbonates BAYER MATERIALSCIENCE AG 2016-01-06 CN disclosed
CN-104817460-A Process for hydrogenating aromatic di- and polyamines BAYER MATERIALSCIENCE AG 2015-08-05 CN disclosed
CN-104817459-A Process for hydrogenating aromatic di- and polyamines to cycloaliphatic di- and polyamines BAYER MATERIALSCIENCE AG 2015-08-05 CN disclosed
EP-2240559-A2 CYCLOALKYL PHENYLENEDIAMINES AS DEPOSIT CONTROL AGENTS FOR LUBRICANTS Chemtura Corporation (US) 2010-10-20 EP disclosed
WO-2009076090-A2 CYCLOALKYL PHENYLENEDIAMINES AS DEPOSIT CONTROL AGENTS FOR LUBRICANTS CHEMTURA CORPORATION (US) 2009-06-18 WO disclosed