SCHEMBL7494368

SCHEMBL7494368

CCn1c(NC2CCN(CCC(CN(C)C(=O)c3ccccc3)c3cccc(Cl)c3)CC2)nc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 20/20 0.54

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
SCHEMBL7497719 0.93 TACR2 (0.52) TACR2
SCHEMBL7500609 0.93 TACR2 (0.57) TACR2
SCHEMBL7499519 0.93 TACR2 (0.52) TACR2
SCHEMBL7492009 0.92 TACR2 (0.52) TACR2
SCHEMBL7491901 0.92 TACR2 (0.52) TACR2
SCHEMBL7500662 0.91 TACR2 (0.50) TACR2
SCHEMBL7503205 0.91 TACR2 (0.51) TACR2
SCHEMBL7496495 0.91 SSTR5 (0.56) TACR2
SCHEMBL7500650 0.91 TACR2 (0.52) TACR2
SCHEMBL7495365 0.90 TACR2 (0.50) TACR2

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-0888336-B1 NOVEL SUBSTITUTED N-METHYL-N-(4-(4-(1H-BENZIMIDAZOL-2-YL-AMINO)P IPERIDIN-1-YL)-2-(ARYL)BUTYL)BENZAMIDES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES AVENTIS PHARMA INC (US) 2002-08-07 EP disclosed
US-5922737-A Substituted N-methyl-N-(4-(4-(1H-Benzimidazol-2-YL-amino) piperidin-1-YL)-2-(arlyl) butyl) benzamides useful for the treatment of allergic diseases HOECHST MARION ROUSSEL, INC. (US) 1999-07-13 US disclosed