SCHEMBL7601060

SCHEMBL7601060

CC(C)OS(=O)(=O)c1cccc(C(=O)NS(=O)(=O)C2CCCCC2)c1N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 1/20 0.38
MRGPRX1 Q96LB2 2/20 0.37
SCN9A Q15858 9/20 0.35
SCN5A Q14524 2/20 0.35
LTB4R Q15722 1/20 0.33
RBP4 P02753 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA3 P07451 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA13 Q8N1Q1 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PPARG P37231 1/20 0.32

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
SCHEMBL6323995 0.76 TAS1R3 (0.42) FPR1MRGPRX1ALDH1A1
SCHEMBL18921210 0.67 ALDH1A1 (0.52) ALDH1A1
SCHEMBL18798786 0.67 MRGPRX1 (0.46) MRGPRX1SCN9ASCN5ARBP4ALDH1A1
SCHEMBL5931179 0.65 RAB9A (0.49) SCN9ASCN5ACA12CA1CA9
SCHEMBL28770026 0.64 ALDH1A1 (0.50) ALDH1A1
SCHEMBL11384280 0.64 BCAT2 (0.42) CA1CA2CA5ACA9ALDH1A1
SCHEMBL17469544 0.64 NPC1 (0.53) SCN9ASCN5AALDH1A1
SCHEMBL30744918 0.63 CTSD (0.54) MRGPRX1
SCHEMBL22169801 0.63 KAT6A (0.51) SCN9ASCN5AALDH1A1
SCHEMBL25256495 0.63 RAB9A (0.47) SCN9ASCN5ACA12CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1264707-A2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2002-12-11 EP disclosed