SCHEMBL7676507

SCHEMBL7676507

COC1C(=C=O)N(c2ccccc2)CCC1c1ccsc1C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HHAT Q5VTY9 1/20 0.30

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
SCHEMBL7669583 0.74 ROCK2 (0.32)
SCHEMBL7834635 0.71 HTT (0.32)
SCHEMBL15552907 0.58 DDB1 (0.56)
SCHEMBL28149421 0.54 MEN1 (0.39)
SCHEMBL7442628 0.54 DDB1 (0.44)
SCHEMBL5084480 0.54 DDB1 (0.47)
SCHEMBL15362058 0.54 MEN1 (0.47)
SCHEMBL15362057 0.54 MEN1 (0.47)
SCHEMBL7606593 0.53 HDAC8 (0.67)
SCHEMBL266004 0.53 MEN1 (0.50)

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-6365602-B1 FOR THERAPY OF DEPRESSION, ANXIETY, ASTHMA, PAIN, INFLAMMATION, URINARY INCONTINENCE AND OTHER DISEASE CONDITIONS ASTRA ZENECA AB (SE) 2002-04-02 US disclosed
EP-1097137-A1 N-SUBSTITUTED NAPHTHALENE CARBOXAMIDES AS NEUROKININ-RECEPTOR ANTAGONISTS AstraZeneca AB (SE) 2001-05-09 EP disclosed
WO-2000002859-A1 N-SUBSTITUTED NAPHTHALENE CARBOXAMIDES AS NEUROKININ-RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2000-01-20 WO disclosed