SCHEMBL11021697

SCHEMBL11021697

CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc(C(=O)OC3CCCN(C)C3)c2C1=O

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ ATM Q13315 1/20 0.53
▸ ANPEP P15144 1/20 0.49
▸ DPP4 P27487 1/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.47
▸ POLB P06746 1/20 0.46
▸ CYP2D6 P10635 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ CDK5 Q00535 1/20 0.41
▸ CDK5R1 Q15078 1/20 0.41
▸ SCN1A P35498 1/20 0.40
▸ SCN2A Q99250 1/20 0.40
▸ SCN3A Q9NY46 1/20 0.40

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
SCHEMBL11018848 0.88 DPP4 (0.55) MEN1KMT2AATMANPEPDPP4
SCHEMBL11019058 0.79 DPP4 (0.52) MEN1KMT2AANPEPDPP4ALDH1A1
SCHEMBL11020066 0.78 DPP4 (0.64) MEN1KMT2AATMANPEPDPP4
SCHEMBL11017735 0.75 DPP4 (0.60) ANPEPDPP4
SCHEMBL11018073 0.75 DPP4 (0.60) MEN1KMT2AANPEPDPP4ALDH1A1
SCHEMBL11019780 0.74 DPP4 (0.62) MEN1KMT2AANPEPDPP4POLB
SCHEMBL11019207 0.74 DPP4 (0.58) MEN1KMT2AATMANPEPDPP4
SCHEMBL11018523 0.74 DPP4 (0.58) ANPEPDPP4
SCHEMBL10878219 0.74 DPP4 (0.68) ANPEPDPP4L3MBTL1ALDH1A1
SCHEMBL11017617 0.74 DPP4 (0.68) ANPEPDPP4ALDH1A1

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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