SCHEMBL5846068

SCHEMBL5846068

O=C(CSc1ccc(C(=O)Nc2ccc(F)cc2)cn1)OCc1cccc(F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 19/20 1.00
CXCR1 P25024 10/20 1.00
MAPT P10636 1/20 0.56

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
SCHEMBL5660018 0.88 CXCR2 (0.79) CXCR2CXCR1
SCHEMBL6850672 0.83 CXCR2 (0.84) CXCR2CXCR1MAPT
SCHEMBL5846981 0.82 CXCR1 (1.00) CXCR2CXCR1
SCHEMBL5846271 0.81 CXCR2 (1.00) CXCR2CXCR1MAPT
SCHEMBL5845444 0.81 CXCR2 (1.00) CXCR2CXCR1MAPT
SCHEMBL6929735 0.79 CXCR2 (0.81) CXCR2CXCR1
SCHEMBL5845286 0.78 CXCR2 (1.00) CXCR2CXCR1
SCHEMBL5845566 0.78 CXCR2 (0.81) CXCR2CXCR1
SCHEMBL5846794 0.77 CXCR2 (0.80) CXCR2CXCR1
SCHEMBL5845414 0.76 CXCR2 (0.78) CXCR2CXCR1

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-7151112-B1 Pharmaceutical uses and synthesis of nicotinamides UCB SA (GB) 2006-12-19 US disclosed