SCHEMBL8641122

SCHEMBL8641122

CC(C)COc1cccc2c1c(=O)c(C(=O)O)nn2-c1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.41
MDM2 Q00987 3/20 0.38
MCL1 Q07820 3/20 0.38
BCL2 P10415 2/20 0.38
NR3C1 P04150 1/20 0.37
APLNR P35414 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
RARG P13631 1/20 0.37
PLA2G2A P14555 1/20 0.37
LMNA P02545 1/20 0.36
GPR35 Q9HC97 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL8638653 0.88 KMT2A (0.43) RORCNR3C1RXFP1RARGPLA2G2A
SCHEMBL8637313 0.85 RORC (0.52) RORCRXFP1RARGTDP1
SCHEMBL9401238 0.79 MAPT (0.43) RORCRXFP1RARGLMNA
SCHEMBL8636437 0.78 MAPK1 (0.41) RORCRXFP1
SCHEMBL30310934 0.77 KMT2A (0.46) RORCRARGLMNA
SCHEMBL8830130 0.77 CYP1A2 (0.41) RORCRARGLMNA
SCHEMBL26074802 0.77 KMT2A (0.46) RORCRARGLMNA
SCHEMBL124027 0.76 MALT1 (0.41) RORCRARG
SCHEMBL8641097 0.76 RORC (0.49) RORCLMNATDP1
SCHEMBL28971929 0.76 CCR1 (0.39) RORCRARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0519140-B1 Method for the preparation of substituted 1,4-dihydro-4-oxo-cinnoline-3-carboxylic acids, esters and salts thereof, and intermediates used in this method HYBRINOVA (FR) 1998-07-29 EP disclosed
US-5696055-A USED IN INDUCING MALE STERILITY OR PRODUCING HYBRID SEEDS IN A GRAMINEOUS PLANT HYBRINOVA S.A. (FR) 1997-12-09 US disclosed
EP-0363236-B1 Pollen suppressant comprising a 5-oxy- or amino-substituted cinnoline HYBRINOVA (FR) 1994-12-07 EP disclosed
US-5332716-A Pollen suppressant comprising a 5-oxy- or amino-substituted cinnoline E.I. DU PONT DE NEMOURS AND COMPANY 1994-07-26 US disclosed
US-5304672-A Intermediates for pollen suppressants ORSAN (FR) 1994-04-19 US disclosed
EP-0530064-A1 Pollen suppressant for Liliopsida plants comprising a 5-oxy-substituted cinnoline HYBRINOVA (FR) 1993-03-03 EP disclosed
EP-0530063-A1 Pollen suppressant for dicotyledon plants comprising a 5-oxy-substituted cinnoline ORSAN (FR) 1993-03-03 EP disclosed
US-5183891-A Method for the preparation of substituted 1,4-dihydro-4-oxo-cinnoline-3-carboxylic acid, esters and salts thereof, and intermediates used in their preparation ORSAN (FR) 1993-02-02 US disclosed
EP-0519140-A1 Method for the preparation of substituted 1,4-dihydro-4-oxo-cinnoline-3-carboxylic acid, esters and salts thereof, and intermediates used in their preparation HYBRINOVA (FR) 1992-12-23 EP disclosed
US-5129940-A Antifertility agents for Liliopsida ORSAN (FR) 1992-07-14 US disclosed
US-5129939-A Antifertility agents ORSAN (FR) 1992-07-14 US disclosed
EP-0363236-A1 Pollen suppressant comprising a 5-oxy- or amino-substituted cinnoline HYBRINOVA (FR) 1990-04-11 EP disclosed