SCHEMBL2054115

SCHEMBL2054115

CNC(=O)N1C[C@H](OC(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 20/20 1.00

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
SCHEMBL2044167 1.00 TACR1 (1.00) TACR1
SCHEMBL5010233 0.89 TACR1 (0.85) TACR1
SCHEMBL5009607 0.89 TACR1 (0.85) TACR1
SCHEMBL12646245 0.83 TACR1 (1.00) TACR1
SCHEMBL14347175 0.83 TACR1 (1.00) TACR1
SCHEMBL3172027 0.83 TACR1 (1.00) TACR1
SCHEMBL5200297 0.83 TACR1 (0.70) TACR1
SCHEMBL5199551 0.83 TACR1 (0.70) TACR1
SCHEMBL5199555 0.83 TACR1 (0.70) TACR1
SCHEMBL4317062 0.82 TACR1 (0.74) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1937264-B1 COMBINATION THERAPY FOR THE TREATMENT OF URINARY FREQUENCY, URINARY URGENCY AND URINARY INCONTINENCE MERCK SHARP & DOHME (US) 2011-06-08 EP claimed