SCHEMBL7345272

SCHEMBL7345272

C[C@@H](C[CH]C(=O)N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 7/20 0.53
CHRM3 P20309 11/20 0.51
CHRM2 P08172 10/20 0.51
CHRM1 P11229 8/20 0.51
YAP1 P46937 1/20 0.47

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
SCHEMBL7338579 1.00 UTS2R (0.53) UTS2RCHRM3CHRM2CHRM1YAP1
SCHEMBL7342585 0.89 YAP1 (0.47) UTS2RCHRM3CHRM2CHRM1YAP1
SCHEMBL7337919 0.89 YAP1 (0.53) YAP1
SCHEMBL7337102 0.88 YAP1 (0.47) UTS2RCHRM3CHRM2CHRM1YAP1
SCHEMBL7339660 0.88 YAP1 (0.50) YAP1
SCHEMBL7342356 0.86 YAP1 (0.51) YAP1
SCHEMBL7348163 0.84 PPARG (0.45) YAP1
SCHEMBL7339723 0.84 MMP9 (0.44) YAP1
SCHEMBL7339909 0.83 PPARG (0.45) YAP1
SCHEMBL7338585 0.83 UTS2R (0.57) UTS2RCHRM3CHRM2CHRM1

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
US-6423689-B1 Peptidyl calcium channel blockers WARNER-LAMBERT COMPANY 2002-07-23 US disclosed