SCHEMBL6467702

SCHEMBL6467702

COc1ccc(S(=O)(=O)NC(=O)NCc2cccc(CNC(=O)NS(=O)(=O)c3ccc(OC)cc3)c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.67
FBP1 P09467 3/20 0.64
SMN1; SMN2 Q16637 1/20 0.55
NAMPT P43490 3/20 0.53
ALDH1A1 P00352 2/20 0.53
CYP2C9 P11712 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
EGFR P00533 2/20 0.52
ERBB2 P04626 1/20 0.52
MAPT P10636 1/20 0.51

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
SCHEMBL8627685 0.91 ALDH1A1 (0.66) SMN1; SMN2NAMPTALDH1A1CYP2C9EGFR
SCHEMBL6467568 0.85 FBP1 (0.78) CYP19A1FBP1SMN1; SMN2ALDH1A1CYP2C9
SCHEMBL6467327 0.82 ALDH1A1 (0.57) FBP1SMN1; SMN2ALDH1A1CYP2C9EGFR
SCHEMBL23447448 0.80 FBP1 (0.78) CYP19A1FBP1SMN1; SMN2NAMPTALDH1A1
SCHEMBL6464484 0.80 SMN1; SMN2 (0.50) SMN1; SMN2NAMPTALDH1A1EGFRERBB2
SCHEMBL6468804 0.79 ALDH1A1 (0.61) FBP1SMN1; SMN2ALDH1A1CYP2C9EGFR
SCHEMBL2006119 0.78 FBP1 (1.00) FBP1SMN1; SMN2ALDH1A1MAPT
SCHEMBL6465069 0.77 CYP19A1 (0.64) CYP19A1SMN1; SMN2ALDH1A1MAPT
SCHEMBL6462708 0.77 FBP1 (0.60) FBP1SMN1; SMN2ALDH1A1CYP2C9EGFR
SCHEMBL6470485 0.76 ALDH1A1 (0.51) FBP1SMN1; SMN2ALDH1A1CYP2C9EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050255998-A1 Mixture of colour developers CIBA SPECIALTY CHEMICALS CORP. 2005-11-17 US disclosed
US-20050106491-A1 Heat sensitive recording material CIBA SPECIALTY CHEMICALS CORP. 2005-05-19 US disclosed
EP-1480835-A1 HEAT SENSITIVE RECORDING MATERIAL Ciba SC Holding AG (CH) 2004-12-01 EP disclosed
WO-2003074285-A1 HEAT SENSITIVE RECORDING MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed
EP-0792755-B1 Thermosensitive recording material OJI PAPER CO (JP) 1998-11-11 EP disclosed
EP-0792755-A1 Thermosensitive recording material OJI PAPER COMPANY LIMITED (JP) 1997-09-03 EP disclosed
US-5612280-A AROMATIC SULFONYLUREA AND SULFONYLTHIOUREA DERIVATIVES AS COLOR DEVELOPERS; COLORFASTNESS, STORAGE STABILITY, WHITENESS NEW OJI PAPER CO., LTD. (JP) 1997-03-18 US disclosed
EP-0604832-A2 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1994-07-06 EP disclosed