SCHEMBL6551292

SCHEMBL6551292

CC(C)c1ccc(S(=O)(=O)c2cc(C(C)OC(=O)N3CCNCC3)c(C#N)cc2C[C@H](N)C(=O)O)c(C(C)C)c1C(C)C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 1/20 0.30

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 SCHEMBL6550006 0.86 PLAU (0.35) —
SCHEMBL6551536 0.84 THRA (0.31) —
SCHEMBL7467500 0.76 PTGDR2 (0.36) —
SCHEMBL4556596 0.71 PLAU (0.41) —
SCHEMBL4556761 0.68 PLAU (0.43) —
SCHEMBL4557815 0.67 ITGB3 (0.42) —
SCHEMBL4619934 0.66 PLAU (0.44) —
SCHEMBL7461704 0.66 PTGDR2 (0.30) —
Hydrochloric Acid SCHEMBL7587516 0.59 KMT2A (0.46) —
SCHEMBL4679033 0.58 GRIN2B (0.52) MGLL

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
EP-1480963-A1 METHOD FOR PRODUCING 3-AMIDINOPHENYLALANINE DERIVATIVES Pentapharm AG (CH) 2004-12-01 — — EP disclosed
WO-2003072559-A1 METHOD FOR PRODUCING 3-AMIDINOPHENYLALANINE DERIVATIVES PENTAPHARM AG (CH) 2003-09-04 — — WO disclosed
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