SCHEMBL15974149

SCHEMBL15974149

CNC(C=O)c1ccsc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.45
▸ SLC6A2 P23975 2/20 0.33
▸ SLC6A4 P31645 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ IDO1 P14902 1/20 0.33
▸ TDO2 P48775 1/20 0.33
▸ CHRNB2 P17787 1/20 0.32
▸ CHRNB4 P30926 1/20 0.32
▸ CHRNA3 P32297 1/20 0.32
▸ CHRNA4 P43681 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
Hydrochloric Acid SCHEMBL15974563 0.98 ALOX5 (0.44) ALOX5SLC6A2SLC6A4CYP3A4CYP2D6
SCHEMBL29958333 0.79 ALOX5 (0.44) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL12066891 0.76 ALOX5 (0.42) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL13455948 0.75 ALOX5 (0.44) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL4950183 0.74 — —
SCHEMBL29957322 0.73 CTSK (0.46) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL13455984 0.73 ALOX5 (0.39) ALOX5CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL24017126 0.73 CYP3A4 (0.43) ALOX5SLC6A2SLC6A4CYP3A4CYP2D6
SCHEMBL24017044 0.73 CYP3A4 (0.43) ALOX5SLC6A2SLC6A4CYP3A4CYP2D6
SCHEMBL20571954 0.71 KMT2A (0.42) ALOX5CYP3A4CYP2D6SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2958897-A2 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 Senomyx, Inc. (US) 2015-12-30 — — EP disclosed
WO-2014130582-A2 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 SENOMYX, INC. (US) 2014-08-28 — — WO disclosed
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