SCHEMBL8638653

SCHEMBL8638653

CCOc1cccc2c1c(=O)c(C(=O)O)nn2-c1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
KDM4E B2RXH2 3/20 0.43
MAPT P10636 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
NSD2 O96028 1/20 0.43
POLB P06746 1/20 0.43
RECQL P46063 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
RORC P51449 2/20 0.42
RXFP1 Q9HBX9 3/20 0.42
ALDH1A1 P00352 3/20 0.42
NPSR1 Q6W5P4 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
APP P05067 1/20 0.41
TP53 P04637 3/20 0.40
HPGD P15428 2/20 0.40
NR3C1 P04150 1/20 0.39
UBE2N P61088 1/20 0.39

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
SCHEMBL9401238 0.90 MAPT (0.43) KMT2AMEN1KDM4EMAPTL3MBTL1
SCHEMBL8641122 0.88 RORC (0.41) RORCRXFP1TDP1NR3C1RARG
SCHEMBL8637313 0.87 RORC (0.52) KMT2AMEN1KDM4EMAPTL3MBTL1
SCHEMBL8830130 0.82 CYP1A2 (0.41) KMT2AKDM4EMAPTRORCNPSR1
SCHEMBL8636437 0.80 MAPK1 (0.41) KMT2AMEN1KDM4EMAPTRORC
SCHEMBL30310934 0.80 KMT2A (0.46) KMT2AMEN1KDM4EMAPTRORC
SCHEMBL26074802 0.80 KMT2A (0.46) KMT2AMEN1KDM4EMAPTRORC
SCHEMBL124027 0.79 MALT1 (0.41) KMT2AMAPTPOLBRORCTP53
SCHEMBL8641097 0.79 RORC (0.49) KMT2AMEN1KDM4EMAPTL3MBTL1
SCHEMBL28971929 0.79 CCR1 (0.39) KMT2AMEN1RORCALDH1A1SMN1; 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 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