SCHEMBL7847280

SCHEMBL7847280

CCc1ccc(COC(=O)NC(C)(Cc2c[nH]c3ccccc23)C(=O)NC(C)c2ccccc2)cc1

nearest known ligand 0.90

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 20/20 0.90

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
SCHEMBL29371285 0.93 TACR1 (1.00) TACR1
SCHEMBL7918701 0.93 TACR1 (1.00) TACR1
SCHEMBL7918704 0.93 TACR1 (1.00) TACR1
SCHEMBL8189477 0.92 TACR1 (0.88) TACR1
SCHEMBL9275375 0.92 TACR1 (1.00) TACR1
SCHEMBL8189473 0.92 TACR1 (0.88) TACR1
SCHEMBL9275371 0.92 TACR1 (1.00) TACR1
SCHEMBL8200980 0.92 TACR1 (1.00) TACR1
SCHEMBL8200979 0.92 TACR1 (1.00) TACR1
SCHEMBL8197471 0.89 TACR1 (1.00) TACR1

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-6258800-B1 Prodrugs of benzofuranylethyl carbamate NK1 antagonists WARNER-LAMBERT COMPANY 2001-07-10 US disclosed
EP-1075472-A1 PRODRUGS OF BENZOFURANYLMETHYL CARBAMATE NK 1? ANTAGONISTS WARNER-LAMBERT COMPANY (US) 2001-02-14 EP disclosed
WO-1999052903-A1 PRODRUGS OF BENZOFURANYLMETHYL CARBAMATE NK1 ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1999-10-21 WO disclosed