SCHEMBL8199591

SCHEMBL8199591

Cc1ncc(CCOC(c2ccc(C(=O)O)c(-c3ccc(F)cc3)c2)c2nccs2)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSA P10619 13/20 0.39
BRS3 P32247 5/20 0.38
CAPN1 P07384 1/20 0.34
HCAR2 Q8TDS4 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
SCHEMBL8194512 0.92 PTGS1 (0.37) CTSABRS3CAPN1
SCHEMBL8185614 0.89 BRS3 (0.43) BRS3
SCHEMBL8193530 0.85 BRS3 (0.35) CTSABRS3
SCHEMBL8194554 0.84 CTSA (0.34) CTSACAPN1
SCHEMBL7561395 0.83 CTSA (0.38) CTSACAPN1
SCHEMBL8185553 0.79 MAPK8 (0.34) CTSABRS3
SCHEMBL7564344 0.78 CYP19A1 (0.40) CTSA
SCHEMBL8185309 0.76 PTGDR2 (0.35) BRS3CAPN1
SCHEMBL7568388 0.75 NAMPT (0.36) CTSA
SCHEMBL8199598 0.74 CTSA (0.39) CTSABRS3

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-1025088-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS AstraZeneca UK Limited (GB) 2000-08-09 EP disclosed
WO-1999020611-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS ZENECA LIMITED (GB) 1999-04-29 WO disclosed