SCHEMBL7486565

SCHEMBL7486565

CCn1c(CC[C@@H]2CCCN2C(=O)Cc2cccc(O)c2)cc2ccc(C(=N)N)cc21

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 10/20 0.38
▸ F10 P00742 8/20 0.38
▸ F7 P08709 1/20 0.36
▸ PRSS1 P07477 5/20 0.33
▸ PLG P00747 1/20 0.33
▸ PLAU P00749 1/20 0.33
▸ TPSAB1 Q15661 1/20 0.33
▸ TPSD1 Q9BZJ3 1/20 0.33
▸ TPSG1 Q9NRR2 1/20 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
SCHEMBL7447663 0.92 PLAU (0.40) F2F10F7PRSS1PLAU
SCHEMBL7488328 0.91 DPP4 (0.38) F2F10F7
SCHEMBL7491657 0.89 MEN1 (0.40) F2F10
SCHEMBL7491327 0.88 F10 (0.38) F2F10F7PRSS1PLAU
SCHEMBL7486269 0.85 ROCK2 (0.37) —
SCHEMBL7453049 0.85 ROCK2 (0.37) —
SCHEMBL7447646 0.84 F2 (0.39) F2F10F7PRSS1PLG
SCHEMBL7491570 0.84 F10 (0.42) F2F10F7PRSS1
SCHEMBL7488683 0.83 F2 (0.37) F2F10F7PRSS1
SCHEMBL7448832 0.83 F2 (0.39) F2F10F7PRSS1PLG

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0918768-B1 AROMATIC AMIDINE DERIVATIVES USEFUL AS SELECTIVE THROMBIN INHIBITORS C & C RES LAB (KR) 2002-01-09 — — EP disclosed
US-6201006-B1 ANTICOAGULANTS C & C RESEARCH LABORATORIES (KR) 2001-03-13 — — US disclosed
EP-0918768-A1 AROMATIC AMIDINE DERIVATIVES USEFUL AS SELECTIVE THROMBIN INHIBITORS C & C Research Laboratories (KR) 1999-06-02 — — EP disclosed
WO-1997045424-A1 AROMATIC AMIDINE DERIVATIVES USEFUL AS SELECTIVE THROMBIN INHIBITORS C & C RESEARCH LABORATORIES (KR) 1997-12-04 — — WO disclosed
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