SCHEMBL7330332

SCHEMBL7330332

C[C@@H]1CCN(C(=O)[C@H](CCCOS(C)(=O)=O)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)[C@@H](C(=O)O)C1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F2 P00734 4/20 0.36
PRSS1 P07477 2/20 0.35
F10 P00742 2/20 0.35
LMNA P02545 1/20 0.35
PLAT P00750 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35

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
SCHEMBL7339153 0.83 ACE (0.41) F2PRSS1F10LMNAPLAT
SCHEMBL7339144 0.83 ACE (0.41) F2PRSS1F10LMNAPLAT
SCHEMBL7335071 0.74 AGTR2 (0.42) LMNA
SCHEMBL7319267 0.72 ALDH1A1 (0.38) LMNA
SCHEMBL7335961 0.71 BCL9 (0.38) LMNA
SCHEMBL8703107 0.68 F2 (0.38) F2PRSS1F10LMNAPLAT
SCHEMBL9234487 0.67 HSD17B10 (0.50) LMNA
SCHEMBL58503 0.67 HSD17B10 (0.50) LMNA
SCHEMBL14211002 0.67 HSD17B10 (0.50) LMNA
SCHEMBL58523 0.67 HSD17B10 (0.50) LMNA

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-5371091-A Anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 1994-12-06 US disclosed