SCHEMBL10402166

SCHEMBL10402166

Cc1nc(SCCNC([O])=O)sc1C

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 12/20 0.39
▸ ALDH1A1 P00352 3/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ GFER P55789 1/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ NPC1 O15118 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ KMT2A Q03164 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
SCHEMBL10402167 0.89 ALOX5 (0.40) ALOX5ALDH1A1HSD17B10MAPTSMN1; SMN2
SCHEMBL10403518 0.85 ALOX5 (0.38) ALOX5ALDH1A1HSD17B10MAPTSMN1; SMN2
SCHEMBL10403230 0.77 GAA (0.54) ALDH1A1MAPTSMN1; SMN2HTTNPC1
SCHEMBL10403521 0.77 ALOX5 (0.39) ALOX5ALDH1A1HSD17B10MAPTSMN1; SMN2
SCHEMBL10404003 0.76 ALDH1A1 (0.37) ALOX5ALDH1A1MAPTSMN1; SMN2HTT
SCHEMBL10968557 0.75 APEX1 (0.47) ALDH1A1HSD17B10MAPTSMN1; SMN2HTT
SCHEMBL13471446 0.74 MAPT (0.42) ALDH1A1HSD17B10MAPTSMN1; SMN2HTT
SCHEMBL13277864 0.73 GAA (0.56) ALDH1A1HSD17B10MAPTGAARAB9A
SCHEMBL10402726 0.72 ALDH1A1 (0.42) ALDH1A1HSD17B10MAPTSMN1; SMN2HTT
SCHEMBL10402728 0.72 ALDH1A1 (0.42) ALDH1A1HSD17B10MAPTSMN1; SMN2MAPK1

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
US-4914206-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-04-03 — — US disclosed
EP-0226896-A2 Lankacidin derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1987-07-01 — — EP disclosed
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