SCHEMBL818902

SCHEMBL818902

C(=CC1CCNCC1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.51
MAOA P21397 2/20 0.49
MAOB P27338 1/20 0.49
KHK P50053 1/20 0.46
SLC18A3 Q16572 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL20015683 1.00 KDM1A (0.51) KDM1AMAOAMAOBKHKSLC18A3
SCHEMBL27140897 1.00 KDM1A (0.51) KDM1AMAOAMAOBKHKSLC18A3
Hydrochloric Acid SCHEMBL27154699 0.98 KDM1A (0.50) KDM1AMAOAMAOBKHKSLC18A3
Hydrochloric Acid SCHEMBL7469122 0.98 KDM1A (0.50) KDM1AMAOAMAOBKHKSLC18A3
Hydrochloric Acid SCHEMBL7469111 0.98 KDM1A (0.50) KDM1AMAOAMAOBKHKSLC18A3
SCHEMBL6011015 0.89 KHK (0.45) KDM1AMAOAMAOBKHKSLC18A3
SCHEMBL817532 0.89 KDM1A (0.46) KDM1AMAOAMAOBKHKALDH1A1
SCHEMBL6011007 0.86 HTR1A (0.46) KDM1AKHKALDH1A1LMNA
SCHEMBL9539801 0.85 MAOA (0.56) KDM1AMAOAMAOBALDH1A1LMNA
SCHEMBL1610007 0.85 MAOA (0.56) KDM1AMAOAMAOBALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102105471-B Novel compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS N.V. (BE) 2014-10-15 CN disclosed
CN-102282132-A Inhibitors of diacylglycerol acyltransferase 2011-12-14 CN disclosed
US-20110275756-A1 CONJUGATED DIENE POLYMER, CONJUGATED DIENE POLYMER COMPOSITION, AND METHOD FOR PRODUCING CONJUGATED DIENE POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-10 US disclosed
US-20110245398-A1 METHOD FOR PRODUCING CONJUGATED DIENE POLYMER COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-06 US disclosed
CN-101160287-B Pyridyl non-aromatic nitrogenated heterocyclic-1-carboxylate ester derivative ASTELLAS PHARMA INC 2011-08-03 CN disclosed
CN-102105471-A Novel compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV 2011-06-22 CN disclosed
CN-100413860-C piperidine derivatives as NMDA receptor antagonists HUNGARY GIREL GYOGYSZERGYAR (HU) 2008-08-27 CN disclosed
CN-101160287-A Pyridyl non-aromatic nitrogenated heterocyclic-1-carboxylate ester derivative ASTELLAS PHARMA INC (JP) 2008-04-09 CN disclosed
CN-1556805-A piperidine derivatives as NMDA receptor antagonists ������ҩ�����޹�˾ 2004-12-22 CN disclosed
CN-1076022-C Cyclic ether compounds as sodium channel modulators TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-12-12 CN disclosed
CN-1223652-A Cyclic ether compounds as sodium channel modulators TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1999-07-21 CN disclosed