SCHEMBL8241302

SCHEMBL8241302

Cc1noc(NS(=O)(=O)C(CC(=O)Nc2ccccc2)C(=O)O)c1C

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EDNRA P25101 2/20 0.52
▸ ALDH1A1 P00352 3/20 0.50
▸ RXFP1 Q9HBX9 1/20 0.50
▸ EDNRB P24530 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ THRB P10828 1/20 0.48
▸ HTT P42858 2/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ RAB9A P51151 1/20 0.47
▸ HPGD P15428 1/20 0.47

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
SCHEMBL17755767 0.73 HPGD (0.49) ALDH1A1KDM4ETSHRHPGD
SCHEMBL17755772 0.73 HPGD (0.49) ALDH1A1KDM4ETSHRHPGD
SCHEMBL11752890 0.72 EDNRA (0.66) EDNRAEDNRB
SCHEMBL17755778 0.71 LMNA (0.44) GAAKDM4EMAPTTSHRRAB9A
SCHEMBL12262674 0.71 ALDH1A1 (0.85) EDNRAALDH1A1RXFP1GAAKDM4E
SCHEMBL6017475 0.70 HTT (0.71) ALDH1A1RXFP1GAAPOLBMAPT
SCHEMBL7857544 0.69 KDM4E (0.66) EDNRAALDH1A1RXFP1EDNRBGAA
SCHEMBL6959046 0.68 EDNRA (0.71) EDNRAALDH1A1RXFP1EDNRBKDM4E
SCHEMBL6151684 0.68 EDNRA (1.00) EDNRAEDNRB
SCHEMBL7338921 0.68 EDNRA (0.71) EDNRAALDH1A1RXFP1EDNRBKDM4E

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-0991427-A2 IMPROVEMENTS IN OR RELATING TO DIAGNOSTIC/THERAPEUTIC AGENTS Marsden, John Christopher (GB) 2000-04-12 — — EP disclosed
EP-0973552-A2 IMPROVEMENTS IN OR RELATING TO DIAGNOSTIC/THERAPEUTIC AGENTS Marsden, John Christopher (GB) 2000-01-26 — — EP disclosed
WO-1998018495-A2 IMPROVEMENTS IN OR RELATING TO DIAGNOSTIC/THERAPEUTIC AGENTS MARSDEN, JOHN, CHRISTOPHER (GB) 1998-05-07 — — WO disclosed
WO-1998018501-A2 IMPROVEMENTS IN OR RELATING TO DIAGNOSTIC/THERAPEUTIC AGENTS MARSDEN, JOHN, CHRISTOPHER (GB) 1998-05-07 — — WO disclosed
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