SCHEMBL7380422

SCHEMBL7380422

CCc1c(C=O)[nH]c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.51
MAPT P10636 3/20 0.43
HKDC1 Q2TB90 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 3/20 0.42
GAA P10253 1/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
KIF11 P52732 3/20 0.42
CYP3A4 P08684 1/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 1/20 0.42
TNKS2 Q9H2K2 1/20 0.42
RAB9A P51151 1/20 0.41
TSHR P16473 1/20 0.41
HPGD P15428 1/20 0.41
POLB P06746 1/20 0.40
GPR3 P46089 1/20 0.40
HSD17B10 Q99714 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
SCHEMBL29956788 1.00 HTT (0.51) HTTMAPTHKDC1NPSR1ALDH1A1
SCHEMBL28804680 0.86 RAB9A (0.54) HTTMAPTHKDC1NPSR1ALDH1A1
SCHEMBL29836517 0.82 KDM4E (0.56) HTTMAPTALDH1A1KDM4EGAA
SCHEMBL29637659 0.82 MAPT (0.43) HTTMAPTHKDC1NPSR1ALDH1A1
SCHEMBL14950314 0.82 HTT (0.47) HTTMAPTALDH1A1KDM4EGAA
SCHEMBL29951907 0.81 MAPT (0.63) HTTMAPTHKDC1NPSR1ALDH1A1
SCHEMBL29836560 0.81 KDM4E (0.57) MAPTALDH1A1KDM4EGAACYP3A4
SCHEMBL28946929 0.81 KDM4E (0.57) MAPTALDH1A1KDM4EGAACYP3A4
SCHEMBL7373958 0.81 ALDH1A1 (0.54) MAPTHKDC1NPSR1ALDH1A1KDM4E
SCHEMBL14092334 0.81 HTT (0.46) HTTMAPTALDH1A1KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1141295-C Indoline derivatives as progesterohe antagonists �Ʒ� 2004-03-10 CN disclosed
CN-1350523-A Indoline derivatives as progesterone antagonists AMERICAN HOME PROD (US) 2002-05-22 CN disclosed
CN-1349416-A Contraceptive compositions contaiing indoline derivatives and progestational agents AMERICAN HOME PROD (US) 2002-05-15 CN disclosed
EP-0420086-B1 Pyrimidoindole derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1995-12-13 EP disclosed
US-5256780-A Serotonin antagonist FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-10-26 US disclosed
US-5180728-A Antagonists of 5-hydroxytryptamine FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1993-01-19 US disclosed
EP-0420086-A2 Pyrimidoindole derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-04-03 EP disclosed