SCHEMBL11248466

SCHEMBL11248466

CC(C(=O)N1C(c2ccncc2)SC[C@H]1C(=O)O)C(S)C(=O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FFAR2 O15552 6/20 0.44
▸ POLB P06746 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ HSD17B10 Q99714 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ ACE P12821 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL11110245 0.93 HSD17B10 (0.48) FFAR2POLBGAARAB9AHSD17B10
SCHEMBL11234757 0.89 KDM4E (0.41) FFAR2HSD17B10ALDH1A1
SCHEMBL11068375 0.89 POLB (0.44) FFAR2POLBGAARAB9AHSD17B10
SCHEMBL11066449 0.84 HTT (0.44) FFAR2POLBGAARAB9AHSD17B10
SCHEMBL11065215 0.84 HTT (0.38) FFAR2POLBGAARAB9AHSD17B10
SCHEMBL11169752 0.84 HTT (0.38) FFAR2POLBGAARAB9AHSD17B10
SCHEMBL11062261 0.82 ACE (0.56) FFAR2POLBALDH1A1HTTACE
SCHEMBL11184480 0.81 FFAR2 (0.52) FFAR2POLBGAARAB9AHSD17B10
SCHEMBL11248462 0.79 KMT2A (0.49) FFAR2POLBGAARAB9AHSD17B10
SCHEMBL11244020 0.78 POLB (0.48) POLBGAARAB9AACE

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-4356183-A ENZYME INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1982-10-26 — — US claimed
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