SCHEMBL7256455

SCHEMBL7256455

CC(C)c1cccc(-c2cc(C(CC(=O)O)C(=O)O)cc(-c3nc4cc(C(=N)N)ccc4[nH]3)c2O)c1

nearest known ligand 0.88

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F7 P08709 18/20 0.88
KLKB1 P03952 11/20 0.73
F3 P13726 1/20 0.67

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
Hydrochloric Acid SCHEMBL7252727 0.99 F7 (0.87) F7KLKB1F3
SCHEMBL7258358 0.91 F7 (0.88) F7KLKB1F3
SCHEMBL6395167 0.91 F7 (0.87) F7KLKB1F3
SCHEMBL6388048 0.90 F7 (0.88) F7KLKB1F3
SCHEMBL6397030 0.90 KLKB1 (0.88) F7KLKB1F3
SCHEMBL7252686 0.90 F7 (0.88) F7KLKB1F3
SCHEMBL7258122 0.89 F7 (0.88) F7KLKB1F3
SCHEMBL7253460 0.89 KLKB1 (0.88) F7KLKB1F3
SCHEMBL6393585 0.89 F3 (0.73) F7KLKB1F3
SCHEMBL7253486 0.88 F7 (0.75) F7KLKB1

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-2003006670-A2 2-[5-(5-CARBAMIMIDOYL-1H-HETEROARYL)-6-HYDROXYBIPHENYL-3-YL]-SUCCINIC ACID DERIVATIVES AS FACTOR VIIA INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2003-01-23 WO claimed
WO-2003006670-A2 2-[5-(5-CARBAMIMIDOYL-1H-HETEROARYL)-6-HYDROXYBIPHENYL-3-YL]-SUCCINIC ACID DERIVATIVES AS FACTOR VIIA INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2003-01-23 WO disclosed