SCHEMBL8276794

SCHEMBL8276794

O=C(NCc1ccc(-c2ccc(F)cc2O)cc1)[C@H](O)[C@@H](O)C(=O)N1CCCC1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ADAM17 P78536 11/20 0.45
▸ MTTP P55157 2/20 0.39
▸ EGFR P00533 1/20 0.38
▸ DPP4 P27487 1/20 0.38

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
SCHEMBL8273552 0.90 ADAM17 (0.43) ADAM17MTTPDPP4
SCHEMBL8222060 0.87 ADAM17 (0.54) ADAM17MTTPDPP4
SCHEMBL8273559 0.87 MEN1 (0.47) ADAM17EGFR
SCHEMBL8275483 0.87 ADAM17 (0.47) ADAM17
SCHEMBL8274825 0.86 ADAM17 (0.52) ADAM17MTTPEGFR
SCHEMBL8215192 0.85 PTGDR2 (0.43) ADAM17
SCHEMBL8215091 0.84 MTTP (0.42) ADAM17MTTP
SCHEMBL8222308 0.83 ADAM17 (0.41) ADAM17MTTP
SCHEMBL8223926 0.82 ADAM17 (0.41) ADAM17MTTP
SCHEMBL8273721 0.81 ADAM17 (0.39) ADAM17DPP4

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
WO-2005121130-A2 CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FOR THE TREATMENT OF INFLAMMATORY DISORDERS SCHERING CORPORATION (US) 2005-12-22 — — WO disclosed
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