SCHEMBL11018003

SCHEMBL11018003

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

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 4/20 0.53
▸ ANPEP P15144 3/20 0.53
▸ ALDH1A1 P00352 6/20 0.47
▸ KDM4E B2RXH2 5/20 0.47
▸ HSD17B10 Q99714 3/20 0.47
▸ CRHBP P24387 1/20 0.38
▸ CRHR2 Q13324 1/20 0.38
▸ PDK2 Q15119 1/20 0.37
▸ GABRA1 P14867 1/20 0.35
▸ GABRB2 P47870 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ POLB P06746 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ IDH1 O75874 1/20 0.34
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 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
SCHEMBL11017209 0.91 DPP4 (0.63) DPP4ANPEPALDH1A1KDM4EHSD17B10
SCHEMBL11019037 0.88 DPP4 (0.56) DPP4ANPEPALDH1A1KDM4EHSD17B10
SCHEMBL11020520 0.87 DPP4 (0.53) DPP4ANPEPALDH1A1KDM4EHSD17B10
SCHEMBL11018664 0.87 DPP4 (0.55) DPP4ANPEPALDH1A1KDM4EHSD17B10
SCHEMBL11017185 0.86 HSD17B10 (0.43) DPP4ANPEPALDH1A1KDM4EHSD17B10
SCHEMBL11019199 0.82 DPP4 (0.41) DPP4ANPEPALDH1A1KDM4EHSD17B10
SCHEMBL11018629 0.81 DPP4 (0.53) DPP4ANPEPALDH1A1CRHBPCRHR2
SCHEMBL11022233 0.81 DPP4 (0.63) DPP4ANPEPALDH1A1HSD17B10CRHBP
SCHEMBL11017039 0.80 DPP4 (0.47) DPP4ANPEPALDH1A1KDM4EHSD17B10
SCHEMBL11019989 0.80 DPP4 (0.49) DPP4ANPEPALDH1A1HSD17B10CRHBP

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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