SCHEMBL18697214

SCHEMBL18697214

C=N/C(=C\C(=C/C)C(=O)O)Cc1cc(F)c2ncc(Cl)cc2c1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 2/20 0.33

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
SCHEMBL20282810 0.86 KLKB1 (0.39) KLKB1
SCHEMBL18697222 0.82 KLKB1 (0.38) KLKB1
SCHEMBL19780593 0.78 KLKB1 (0.37) KLKB1
SCHEMBL20282952 0.74 KLKB1 (0.36) KLKB1
SCHEMBL21177281 0.74 SIRT1 (0.38) KLKB1
SCHEMBL21179410 0.73 HSP90AB1 (0.42) KLKB1
SCHEMBL21179367 0.73 KLKB1 (0.36) KLKB1
SCHEMBL20616461 0.72 KLKB1 (0.31) KLKB1
SCHEMBL21179353 0.71 KLKB1 (0.36) KLKB1
SCHEMBL19779861 0.71 CYP1A2 (0.38) KLKB1

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-9611252-B2 Therapeutic inhibitory compounds LIFESCI PHARMACEUTICALS, INC. (BB) 2017-04-04 US disclosed