SCHEMBL7867249

SCHEMBL7867249

Cn1cncc1CC(OCc1ccc(C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)OC(C)(C)C)c(-c2ccc(F)cc2)c1)c1nccs1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
MAPK1 P28482 2/20 0.31
AGTR2 P50052 1/20 0.31

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
SCHEMBL7564177 0.92 FNTA (0.38) FNTAFNTB
SCHEMBL7565353 0.90 FNTA (0.33) CAPN1FNTAFNTBMAPK1
SCHEMBL7867254 0.85 FNTA (0.35) CAPN1FNTAFNTB
SCHEMBL7565485 0.83 FNTA (0.48) FNTAFNTB
SCHEMBL7567718 0.82 FNTA (0.32) CAPN1FNTAFNTB
SCHEMBL7570953 0.82 FNTA (0.41) FNTAFNTBMAPK1
SCHEMBL7568380 0.81 GRM2 (0.36) CAPN1
SCHEMBL7561389 0.81 CTSA (0.36) CAPN1MAPK1
SCHEMBL7692641 0.79 CAPN1 (0.34) CAPN1FNTAFNTB
SCHEMBL7562210 0.78 FNTA (0.41) FNTAFNTB

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
EP-1025088-B1 IMIDAZOLE DERIVATIVES AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS ASTRAZENECA AB (SE) 2001-09-05 EP disclosed