SCHEMBL2479360

SCHEMBL2479360

CC(=O)N(C)C1(c2ccccc2)CCN(CC2CC2(C(=O)N(C)Cc2ccc(F)cc2)c2ccc(Cl)cc2)CC1

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR3 P29371 20/20 0.78

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
SCHEMBL2478631 1.00 TACR3 (0.78) TACR3
SCHEMBL2481719 0.96 TACR3 (0.77) TACR3
SCHEMBL2475924 0.96 TACR3 (0.77) TACR3
SCHEMBL2479733 0.95 TACR3 (0.75) TACR3
SCHEMBL2480045 0.95 TACR3 (0.75) TACR3
SCHEMBL2479822 0.94 TACR3 (0.82) TACR3
SCHEMBL2477971 0.94 TACR3 (0.82) TACR3
SCHEMBL2479997 0.90 TACR3 (0.81) TACR3
SCHEMBL2479996 0.90 TACR3 (0.81) TACR3
SCHEMBL2480244 0.89 TACR3 (0.70) TACR3

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
EP-1656349-B1 CYCLOPROPYL DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS LUNDBECK & CO AS H (DK) 2011-10-12 EP disclosed