SCHEMBL8637494

SCHEMBL8637494

O=C(O)c1nn(-c2ccc(Cl)cc2)c2cccc(Cl)c2c1=O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RORC P51449 11/20 0.49
CYP1A2 P05177 1/20 0.49
HIF1A Q16665 1/20 0.49
RARG P13631 8/20 0.46
KDM4E B2RXH2 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALDH1A1 P00352 1/20 0.43
ABCB1 P08183 3/20 0.42
PTGS2 P35354 1/20 0.41
RPA1 P27694 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
SCHEMBL8830183 0.87 RORC (0.52) RORCCYP1A2HIF1ARARGKDM4E
SCHEMBL30212115 0.87 RORC (0.52) RORCCYP1A2HIF1ARARGKDM4E
SCHEMBL10663975 0.86 RORC (0.51) RORCCYP1A2HIF1ARARGKDM4E
Potassium SCHEMBL10663990 0.86 RORC (0.51) RORCCYP1A2HIF1ARARGKDM4E
SCHEMBL8636450 0.85 KMT2A (0.48) RORCCYP1A2RARGSMN1; SMN2MAPT
SCHEMBL24047601 0.84 CYP1A2 (0.45) RORCCYP1A2HIF1ARARGKDM4E
SCHEMBL9569710 0.84 RORC (0.46) RORCCYP1A2HIF1ARARGKDM4E
SCHEMBL26074925 0.84 CYP1A2 (0.45) RORCCYP1A2HIF1ARARGKDM4E
SCHEMBL30626334 0.84 CYP1A2 (0.45) RORCCYP1A2HIF1ARARGKDM4E
SCHEMBL8830115 0.84 RORC (0.44) RORCRARGKDM4ESMN1; SMN2LMNA

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 4 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-5304672-A Intermediates for pollen suppressants ORSAN (FR) 1994-04-19 US 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