SCHEMBL11378167

SCHEMBL11378167

CCOC(=O)c1ccc(C(=O)NC(=O)N2CC2C#N)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.47
▸ PREP P48147 1/20 0.47
▸ DPP8 Q6V1X1 1/20 0.47
▸ DPP9 Q86TI2 1/20 0.47
▸ DPP7 Q9UHL4 1/20 0.47
▸ RAB9A P51151 6/20 0.43
▸ SMN1; SMN2 Q16637 5/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ GAA P10253 2/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ CA12 O43570 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ ESR1 P03372 1/20 0.42
▸ CA7 P43166 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ ESR2 Q92731 1/20 0.42
▸ CA14 Q9ULX7 1/20 0.42
▸ HPGD P15428 2/20 0.42
▸ HTT P42858 2/20 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
SCHEMBL6949514 0.85 RAB9A (0.57) RAB9ASMN1; SMN2NPC1GAAALDH1A1
SCHEMBL11378964 0.84 ALDH1A1 (0.48) DPP4PREPDPP8DPP9DPP7
SCHEMBL11381450 0.83 PREP (0.48) DPP4PREPDPP8DPP9DPP7
SCHEMBL11378390 0.82 DPP4 (0.41) DPP4PREPDPP8DPP9DPP7
SCHEMBL11380434 0.81 ALOX15 (0.54) DPP4DPP8DPP9DPP7RAB9A
SCHEMBL11382395 0.81 RAB9A (0.42) DPP4RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL11369671 0.79 KMT2A (0.50) DPP4SMN1; SMN2GAAALDH1A1MEN1
SCHEMBL11412004 0.79 CTSB (0.47) DPP4PREPDPP8DPP9DPP7
SCHEMBL11381416 0.79 KMT2A (0.44) PREPRAB9ASMN1; SMN2NPC1ESR1
SCHEMBL11373157 0.79 PREP (0.49) DPP4PREPDPP7RAB9ANPC1

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-4282212-A Immune-stimulating 1-(N-acylcarbamoyl)-2-cyanoaziridines BOEHRINGER MANNHEIM GMBH (DE) 1981-08-04 — — US disclosed
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