SCHEMBL11018664

SCHEMBL11018664

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 4/20 0.55
▸ ANPEP P15144 3/20 0.55
▸ CRHBP P24387 1/20 0.39
▸ CRHR2 Q13324 1/20 0.39
▸ GABRA1 P14867 1/20 0.37
▸ GABRB2 P47870 1/20 0.37
▸ HSD17B10 Q99714 6/20 0.35
▸ KDM4E B2RXH2 4/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ CYP1A2 P05177 2/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ CYP2C19 P33261 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ HTT P42858 2/20 0.34
▸ ALOX15 P16050 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ ALOX12 P18054 1/20 0.34

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
SCHEMBL11020051 0.91 DPP4 (0.66) DPP4ANPEPCRHBPCRHR2HSD17B10
SCHEMBL11019037 0.90 DPP4 (0.56) DPP4ANPEPCRHBPCRHR2GABRA1
SCHEMBL11018003 0.87 DPP4 (0.53) DPP4ANPEPCRHBPCRHR2GABRA1
SCHEMBL11020520 0.87 DPP4 (0.53) DPP4ANPEPCRHBPCRHR2GABRA1
SCHEMBL11019260 0.86 DPP4 (0.39) DPP4ANPEPGABRA1GABRB2HSD17B10
SCHEMBL11016555 0.83 DPP4 (0.56) DPP4ANPEPCRHBPCRHR2HSD17B10
SCHEMBL11017039 0.82 DPP4 (0.47) DPP4ANPEPGABRA1GABRB2HSD17B10
SCHEMBL11018217 0.82 DPP4 (0.54) DPP4ANPEPCRHBPCRHR2HSD17B10
SCHEMBL11019967 0.81 DPP4 (0.53) DPP4ANPEPCRHBPCRHR2HSD17B10
SCHEMBL11017460 0.81 DPP4 (0.42) DPP4ANPEPTYMSCTDSP1

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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