SCHEMBL8340095

SCHEMBL8340095

O=CC(C=O)c1nc2ccccc2s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.53
▸ LOXL2 Q9Y4K0 1/20 0.51
▸ HSD17B10 Q99714 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ HIF1A Q16665 1/20 0.49
▸ ALOX5 P09917 1/20 0.48
▸ PSMB8 P28062 1/20 0.44
▸ PSMB5 P28074 1/20 0.44
▸ CASR P41180 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ ADRA2A P08913 1/20 0.44
▸ FBP1 P09467 1/20 0.44
▸ ADORA3 P0DMS8 1/20 0.44
▸ DRD2 P14416 1/20 0.44
▸ ALOX15 P16050 1/20 0.44

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
SCHEMBL3413661 0.82 HPGD (0.50) HPGDLOXL2HSD17B10CYP1A2CYP2C9
SCHEMBL21694384 0.78 MAPK9 (0.48) HPGDLOXL2HSD17B10CYP1A2CYP2C9
SCHEMBL6240188 0.76 LOXL2 (0.62) HPGDLOXL2HSD17B10CYP1A2CYP2C9
SCHEMBL16383316 0.75 HPGD (0.58) HPGDLOXL2HSD17B10CYP1A2CYP2C9
SCHEMBL62420 0.75 LOXL2 (0.66) HPGDLOXL2HSD17B10CYP1A2CYP2C9
SCHEMBL29971249 0.75 HPGD (0.58) HPGDLOXL2HSD17B10CYP1A2CYP2C9
SCHEMBL10351068 0.75 HPGD (0.58) HPGDLOXL2HSD17B10CYP1A2CYP2C9
SCHEMBL2146969 0.75 LOXL2 (0.66) HPGDLOXL2HSD17B10CYP1A2CYP2C9
SCHEMBL30943481 0.74 HPGD (0.57) HPGDLOXL2HSD17B10CYP1A2CYP2C9
SCHEMBL1001902 0.74 HPGD (0.57) HPGDLOXL2HSD17B10CYP1A2CYP2C9

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
US-6008350-A CATIONIC CYANINE DYES OF GIVEN FORMULA; USEFUL IN HEAT MODE RECORDING MATERIALS AGFA-GEVAERT (BE) 1999-12-28 — — US disclosed
EP-0719304-B1 CYANINE DYES AND PROCESS FOR THE PRODUCTION AGFA GEVAERT NV (BE) 1998-12-23 — — EP disclosed
EP-0719304-A1 PROCESS FOR THE PRODUCTION OF CYANINE DYES AGFA-GEVAERT N.V. (BE) 1996-07-03 — — EP disclosed
WO-1995007950-A1 PROCESS FOR THE PRODUCTION OF CYANINE DYES AGFA-GEVAERT NAAMLOZE VENNOOTSCHAP (BE) 1995-03-23 — — WO disclosed
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