SCHEMBL11375540

SCHEMBL11375540

N#CC1CN1C(=O)CNC(=O)CSc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PREP P48147 8/20 0.49
▸ DPP7 Q9UHL4 1/20 0.46
▸ DPP4 P27487 2/20 0.44
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL11383827 0.86 FKBP1A (0.51) DPP4NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL11381209 0.81 PREP (0.58) PREPDPP7DPP4KMT2AL3MBTL1
SCHEMBL11380258 0.80 DPP4 (0.45) PREPDPP7DPP4
SCHEMBL11380874 0.78 PREP (0.73) PREPDPP7DPP4
SCHEMBL11379685 0.78 PREP (0.60) PREPDPP7DPP4KMT2ASMN1; SMN2
SCHEMBL11377789 0.76 DPP4 (0.50) PREPDPP7DPP4
SCHEMBL11376269 0.75 PREP (0.53) PREPDPP7DPP4
SCHEMBL11375925 0.74 PREP (0.63) PREPDPP7DPP4
SCHEMBL11375543 0.74 PREP (0.53) PREPDPP7DPP4
SCHEMBL11386013 0.73 PREP (0.76) PREPDPP7DPP4SMN1; SMN2ALDH1A1

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-4267174-A AND PROCESS FOR ADMINISTERING BOEHRINGER MANNHEIM, GMBH (DE) 1981-05-12 — — US disclosed
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