SCHEMBL6329425

SCHEMBL6329425

CCCCOC(=O)c1cccc(NC(=O)NS(=O)(=O)c2ccccc2C)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.58
RAB9A P51151 4/20 0.58
NPC1 O15118 3/20 0.58
HPGD P15428 2/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
MAPT P10636 4/20 0.52
TP53 P04637 2/20 0.52
ALDH1A1 P00352 1/20 0.51
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
POLB P06746 2/20 0.50
LMNA P02545 1/20 0.50
PKM P14618 1/20 0.50
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
PPARA Q07869 1/20 0.46

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
SCHEMBL6331748 0.96 SMN1; SMN2 (0.53) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL6326659 0.96 SMN1; SMN2 (0.53) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL6323993 0.96 SMN1; SMN2 (0.53) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL1931137 0.95 SMN1; SMN2 (0.50) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL1931062 0.95 SMN1; SMN2 (0.50) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL1928184 0.94 SMN1; SMN2 (0.49) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL1929112 0.94 SMN1; SMN2 (0.49) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL1929593 0.94 SMN1; SMN2 (0.49) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL1930264 0.94 SMN1; SMN2 (0.49) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL1929853 0.94 SMN1; SMN2 (0.49) SMN1; SMN2RAB9ANPC1HPGDCYP1A2

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