SCHEMBL21177602

SCHEMBL21177602

O=Cc1nc(Cc2ccc3ncc(Cl)cc3c2)co1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 20/20 0.44
MAP4K1 Q92918 12/20 0.44

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
SCHEMBL21177523 0.81 KLKB1 (0.46) KLKB1MAP4K1
SCHEMBL21177641 0.80 KLKB1 (0.48) KLKB1MAP4K1
SCHEMBL21177562 0.79 KLKB1 (0.30) KLKB1MAP4K1
SCHEMBL19780753 0.78 KLKB1 (0.45) KLKB1MAP4K1
SCHEMBL23279803 0.77 KLKB1 (0.54) KLKB1MAP4K1
SCHEMBL21177301 0.75 KLKB1 (0.40) KLKB1MAP4K1
SCHEMBL18369645 0.73 KLKB1 (0.42) KLKB1MAP4K1
SCHEMBL20531526 0.73 KLKB1 (0.46) KLKB1MAP4K1
SCHEMBL21028255 0.72 KLKB1 (0.60) KLKB1MAP4K1
SCHEMBL18369665 0.72 KLKB1 (0.43) KLKB1MAP4K1

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
WO-2019142053-A2 THERAPEUTIC INHIBITORY COMPOUNDS LIFESCI PHARMACEUTICALS, INC. (BB) 2019-07-25 WO disclosed
WO-2019142053-A2 THERAPEUTIC INHIBITORY COMPOUNDS LIFESCI PHARMACEUTICALS, INC. (BB) 2019-07-25 WO disclosed