SCHEMBL11019989

SCHEMBL11019989

CCc1cccc(C(C)CC)c1N1C(=O)c2cccc(C(=O)NC)c2C1=O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 5/20 0.49
▸ ANPEP P15144 4/20 0.49
▸ POLB P06746 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ CRHBP P24387 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PDK2 Q15119 1/20 0.34
▸ IDH1 O75874 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ TYMS P04818 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
SCHEMBL11018629 0.91 DPP4 (0.53) DPP4ANPEPPOLBALDH1A1CYP1A2
SCHEMBL11021544 0.88 DPP4 (0.52) DPP4ANPEPALDH1A1MAPTCRHBP
SCHEMBL11021844 0.88 ALDH1A1 (0.47) DPP4ANPEPPOLBALDH1A1MAPT
SCHEMBL11017209 0.88 DPP4 (0.63) DPP4ANPEPPOLBALDH1A1CYP1A2
SCHEMBL11016927 0.87 ANPEP (0.49) DPP4ANPEPPOLBMAPTCRHBP
SCHEMBL11022166 0.87 ANPEP (0.45) DPP4ANPEPPOLBALDH1A1CRHBP
SCHEMBL11018418 0.87 DPP4 (0.51) DPP4ANPEPCRHBPCRHR2ALOX15
SCHEMBL11022123 0.82 DPP4 (0.55) DPP4ANPEPCRHBPCRHR2
SCHEMBL11021461 0.82 DPP4 (0.64) DPP4ANPEPPOLBALDH1A1CYP1A2
SCHEMBL11019049 0.81 AHR (0.53) DPP4ANPEPALDH1A1MAPTALOX15

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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