SCHEMBL8864748

SCHEMBL8864748

COC(=O)CCc1ccc(S(=O)(=O)N(C)Cc2ccc(OC)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 5/20 0.54
TAS2R14 Q9NYV8 8/20 0.53
F2RL1 P55085 1/20 0.51
ALDH1A1 P00352 1/20 0.50
PTGES O14684 1/20 0.50
TAS2R8 Q9NYW2 1/20 0.50
CXCR3 P49682 1/20 0.50
MAPK1 P28482 1/20 0.49
MEP1B Q16820 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL1445627 0.82 F2RL1 (0.73) F2RL1ALDH1A1LMNA
SCHEMBL1278905 0.80 TAS2R14 (0.80) TAS2R14PTGESTAS2R8CXCR3MEP1B
SCHEMBL29966020 0.79 LMNA (0.63) TAS2R14ALDH1A1MAPK1LMNA
SCHEMBL6958238 0.78 TAS2R14 (0.64) TAS2R14ALDH1A1PTGESTAS2R8CXCR3
SCHEMBL4012164 0.78 TAS2R14 (0.53) TAS2R14ALDH1A1PTGESTAS2R8CXCR3
SCHEMBL14285692 0.78 TAS2R14 (0.64) TAS2R14ALDH1A1PTGESTAS2R8CXCR3
SCHEMBL22265923 0.78 ALDH1A1 (0.66) BMP1TAS2R14ALDH1A1PTGESTAS2R8
SCHEMBL29955588 0.77 TAS2R14 (0.53) BMP1TAS2R14ALDH1A1PTGESTAS2R8
SCHEMBL2277479 0.77 F2RL1 (0.67) F2RL1ALDH1A1LMNA
SCHEMBL8558353 0.77 ALDH1A1 (0.55) BMP1TAS2R14ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5667931-A THERMAL RESISTANCE, RESOLUTION, PHOTOSENSITIVITY KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 1997-09-16 US disclosed
US-5624922-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1997-04-29 US disclosed
EP-0597540-B1 Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC (US) 1996-06-05 EP disclosed
US-5380721-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1995-01-10 US disclosed
EP-0597540-A1 Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1994-05-18 EP disclosed