SCHEMBL7414760

SCHEMBL7414760

C=CCOc1cc(NC(C)=O)c(Cl)cc1C(=O)OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.50
HPGD P15428 7/20 0.48
ALDH1A1 P00352 7/20 0.48
KDM4E B2RXH2 4/20 0.48
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
NPSR1 Q6W5P4 1/20 0.46
AGER Q15109 1/20 0.45
LMNA P02545 2/20 0.45
MAPT P10636 2/20 0.45
RAB9A P51151 2/20 0.45
NPY1R P25929 1/20 0.45
NPY2R P49146 1/20 0.45
GLA P06280 1/20 0.44
HSD17B10 Q99714 2/20 0.44
TDP1 Q9NUW8 1/20 0.42
GAA P10253 2/20 0.41
TSHR P16473 1/20 0.41
NPC1 O15118 1/20 0.41
PPARG P37231 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
SCHEMBL10784419 0.89 ALDH1A1 (0.44) HTTHPGDALDH1A1KDM4EPOLB
SCHEMBL10353913 0.89 GAA (0.54) HTTHPGDALDH1A1KDM4EPOLB
SCHEMBL7367528 0.84 TDP1 (0.59) HTTHPGDALDH1A1KDM4EPOLB
SCHEMBL20677873 0.84 GAA (0.47) HTTHPGDALDH1A1KDM4EPOLB
SCHEMBL20099475 0.82 HTT (0.52) HTTHPGDALDH1A1KDM4EPOLB
SCHEMBL28758846 0.82 HTT (0.52) HTTHPGDALDH1A1KDM4EPOLB
SCHEMBL130152 0.81 HTT (0.72) HTTHPGDALDH1A1KDM4EPOLB
SCHEMBL28733136 0.81 HTT (0.51) HTTHPGDALDH1A1KDM4EPOLB
SCHEMBL7409017 0.81 GAA (0.65) ALDH1A1KDM4ESMN1; SMN2LMNAGLA
SCHEMBL5321109 0.80 HTT (0.50) HTTHPGDALDH1A1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9957257-B2 Amide compounds as 5-HT4 receptor agonists SUVEN LIFE SCIENCES LIMITED (IN) 2018-05-01 US disclosed
US-5063230-A Substituted saturated and unsaturated indole quinoline and benzazepine carboxamides and their use as pharmacological agents RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-11-05 US disclosed
WO-1990006113-A1 SUBSTITUTED SATURATED AND UNSATURATED INDOLE QUINOLINE AND BENZAZEPINE CARBOXAMIDES AND THEIR USE AS PHARMACOLOGICAL AGENTS RORER INTERNATIONAL (OVERSEAS) INC. (US) 1990-06-14 WO disclosed
US-4920219-A Substituted saturated and unsaturated indole quinoline and benzazepine carboxamides and their use as pharmacological agents RORER PHARMACEUTICAL CORP. (US) 1990-04-24 US disclosed
US-4914117-A ANTIDEPRESSANTS, CENTRAL NERVOUS SYSTEM ACTIVATORS; DOPAMINE ANTAGONISTS SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLE DE L'ILE-D-FRANCE (FR) 1990-04-03 US disclosed
US-4835172-A Novel benzamides, intermediates and process for the preparation and therapeutic use thereof SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) 1989-05-30 US disclosed