SCHEMBL11021587

SCHEMBL11021587

CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc(C(=O)OCc3ccc([N+](=O)[O-])cc3)c2C1=O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ANPEP P15144 2/20 0.48
▸ DPP4 P27487 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ HTT P42858 2/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HTR2A P28223 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ PAX8 Q06710 1/20 0.38

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
SCHEMBL11016496 0.87 DPP4 (0.53) ANPEPDPP4RAB9AKMT2ASMN1; SMN2
SCHEMBL11019151 0.83 ANPEP (0.48) ANPEPDPP4L3MBTL1SMN1; SMN2
SCHEMBL11019792 0.81 ANPEP (0.46) ANPEPDPP4L3MBTL1KMT2ASMN1; SMN2
SCHEMBL11018073 0.81 DPP4 (0.60) ANPEPDPP4RAB9ANPC1KMT2A
SCHEMBL11021403 0.80 DPP4 (0.49) ANPEPDPP4RAB9AL3MBTL1KMT2A
SCHEMBL11018238 0.80 DPP4 (0.51) ANPEPDPP4RAB9AHTTNPC1
SCHEMBL11019207 0.80 DPP4 (0.58) ANPEPDPP4RAB9AHTTNPC1
SCHEMBL11018520 0.79 DPP4 (0.57) ANPEPDPP4NPC1KMT2A
SCHEMBL11021398 0.79 DPP4 (0.57) ANPEPDPP4L3MBTL1KMT2AALDH1A1
SCHEMBL11021646 0.78 DPP4 (0.56) ANPEPDPP4NPC1KMT2A

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-0152021-A2 Phthalimide derivatives, their preparation and their use as agricultural fungicides SANKYO COMPANY LIMITED (JP) 1985-08-21 — — EP disclosed
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