SCHEMBL13613697

SCHEMBL13613697

Cc1ccc(NC(=O)Nc2cccc3c2CC(O)CC3)cc1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 17/20 0.62
RAB9A P51151 2/20 0.49
NPC1 O15118 1/20 0.44
POLB P06746 1/20 0.44
STING1 Q86WV6 1/20 0.43

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
SCHEMBL13613655 0.93 TRPV1 (0.56) TRPV1RAB9A
SCHEMBL13613711 0.89 TRPV1 (0.61) TRPV1RAB9ANPC1
SCHEMBL13613710 0.89 TRPV1 (0.64) TRPV1
SCHEMBL4336612 0.89 TRPV1 (0.64) TRPV1
SCHEMBL13613604 0.88 TRPV1 (0.63) TRPV1RAB9ANPC1
SCHEMBL206358 0.88 TRPV1 (0.58) TRPV1
SCHEMBL13613600 0.88 TRPV1 (0.66) TRPV1RAB9ANPC1POLB
SCHEMBL13613602 0.88 TRPV1 (0.62) TRPV1RAB9ANPC1STING1
SCHEMBL4341397 0.88 TRPV1 (0.69) TRPV1RAB9ANPC1
SCHEMBL13613699 0.87 TRPV1 (0.62) TRPV1RAB9ANPC1

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
US-7612113-B2 Such as N-[4-chloro-3-(trifluoromethyl)phenyl]-N'-(7-hydroxy-5,6,7,8-tetrahydro-1-naphthalenyl)urea; vanilloid receptor antagonists; for treatment of urge urinary incontinence, overactive bladder, chronic pain, neuropathic pain, postoperative pain, rheumatoid arthritic pain, neuralgia, neuropathies, COPD XENTION LIMITED (GB) 2009-11-03 US disclosed
US-7612113-B2 Such as N-[4-chloro-3-(trifluoromethyl)phenyl]-N'-(7-hydroxy-5,6,7,8-tetrahydro-1-naphthalenyl)urea; vanilloid receptor antagonists; for treatment of urge urinary incontinence, overactive bladder, chronic pain, neuropathic pain, postoperative pain, rheumatoid arthritic pain, neuralgia, neuropathies, COPD XENTION LIMITED (GB) 2009-11-03 US disclosed