SCHEMBL8316320

SCHEMBL8316320

COCN1c2cc(Cn3cnc4c(SCCCC(=O)O)ncnc43)ccc2Sc2nccnc21

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 18/20 0.38
HDAC6 Q9UBN7 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
SCHEMBL6749372 0.92 EP300 (0.38) SLC29A1
SCHEMBL6752245 0.89 EP300 (0.39) SLC29A1
SCHEMBL6749165 0.84 HDAC6 (0.37) SLC29A1HDAC6
SCHEMBL6750499 0.80 PDE10A (0.36) HDAC6
SCHEMBL6749417 0.80 FGFR1 (0.42) HDAC6
SCHEMBL6749471 0.80 DAPK1 (0.33) SLC29A1HDAC6
SCHEMBL6745829 0.79 DAPK1 (0.34) SLC29A1HDAC6
SCHEMBL6747470 0.79 HDAC6 (0.33) SLC29A1HDAC6
SCHEMBL6745740 0.79 HDAC6 (0.32) HDAC6
SCHEMBL6745469 0.79 HDAC6 (0.32) HDAC6

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-0934941-A1 BENZOPIPERIDINE DERIVATIVES Eisai Co., Ltd. (JP) 1999-08-11 EP disclosed