SCHEMBL7709573

SCHEMBL7709573

CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)c1cnc(S(C)(=O)=O)nc1-c1ccccc1F

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 19/20 0.55

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
SCHEMBL7702182 0.79 TACR1 (0.60) TACR1
SCHEMBL7704059 0.78 TACR1 (0.51) TACR1
SCHEMBL7707100 0.78 TACR1 (0.64) TACR1
SCHEMBL5966366 0.78 TACR1 (0.81) TACR1
SCHEMBL5780710 0.77 TACR1 (0.69) TACR1
SCHEMBL5779622 0.75 TACR1 (0.75) TACR1
SCHEMBL6016592 0.74 NPC1 (0.45)
SCHEMBL5782663 0.74 TACR1 (0.72) TACR1
SCHEMBL6016333 0.73 TACR1 (0.56) TACR1
SCHEMBL5779692 0.73 TACR1 (0.73) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1187815-A1 4-PHENYL-PYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-03-20 EP disclosed
WO-2000073279-A1 4-PHENYL-PYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2000-12-07 WO disclosed