SCHEMBL6326121

SCHEMBL6326121

Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc(S(=O)(=O)OC3CCCCC3)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.62
CA12 O43570 2/20 0.58
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
CA4 P22748 2/20 0.58
CA6 P23280 2/20 0.58
CA5A P35218 2/20 0.58
CA7 P43166 2/20 0.58
CA9 Q16790 2/20 0.58
CA13 Q8N1Q1 2/20 0.58
CA14 Q9ULX7 2/20 0.58
LMNA P02545 1/20 0.57
ADORA3 P0DMS8 1/20 0.57
RAB9A P51151 2/20 0.56
PPARG P37231 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
NR2E3 Q9Y5X4 1/20 0.56
NCOR2 Q9Y618 1/20 0.56
HRH3 Q9Y5N1 2/20 0.53
ENPP3 O14638 2/20 0.53

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
SCHEMBL6324835 0.88 LMNA (0.55) TP53CA12CA1CA2CA4
SCHEMBL6727901 0.84 TP53 (0.59) TP53CA12CA1CA2CA4
SCHEMBL6324545 0.82 TP53 (0.54) TP53CA12CA1CA2CA4
Methyl Alcohol SCHEMBL1553775 0.81 CYP2D6 (0.62) TP53LMNAADORA3ENPP3ENPP1
SCHEMBL24250706 0.81 CYP2D6 (0.61) TP53CA1CA2LMNAADORA3
SCHEMBL8370244 0.81 CYP2D6 (0.61) TP53CA1CA2LMNAADORA3
SCHEMBL22621292 0.81 CYP2D6 (0.61) TP53CA1CA2LMNAADORA3
SCHEMBL1928662 0.81 CA12 (0.85) TP53CA12CA1CA2CA4
SCHEMBL23192021 0.81 CYP2D6 (0.61) TP53CA1CA2LMNAADORA3
SCHEMBL9060935 0.81 CYP2D6 (0.61) TP53CA1CA2LMNAADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6858565-B2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2005-02-22 US disclosed
US-20030040434-A1 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2003-02-27 US disclosed
EP-1264707-A2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2002-12-11 EP disclosed