SCHEMBL27705374

SCHEMBL27705374

C=Cc1cc(CNC(=O)OCCCC)ccc1NS(C)(=O)=O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TRPV1 Q8NER1 1/20 0.38
FAAH O00519 2/20 0.38

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
SCHEMBL2948935 0.81 CA1 (0.43) TRPV1
SCHEMBL2959317 0.81 KDM4E (0.44)
SCHEMBL5500652 0.77 CA1 (0.41) TRPV1
SCHEMBL5505542 0.76
SCHEMBL2958972 0.76 MEN1 (0.51) SMN1; SMN2TRPV1
SCHEMBL13387445 0.74 FAAH (0.58) TSHRSMN1; SMN2FAAH
SCHEMBL2948213 0.74 TRPV1 (0.57) TRPV1
SCHEMBL5272637 0.73 TRPV1 (0.48) TRPV1
SCHEMBL5282552 0.73 TRPV1 (0.41) TRPV1
SCHEMBL13238790 0.72 TRPV1 (0.37) TRPV1

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
CN-101142174-A Novel compounds as vanilloid receptor antagonists, isomers thereof or pharmaceutically acceptable salts thereof; and pharmaceutical compositions comprising the same AMOREPACIFIC CORP (KR) 2008-03-12 CN disclosed