SCHEMBL11017365

SCHEMBL11017365

C=CCc1ccc(C)c(C)c1N1C(=O)c2cccc(C(=O)O)c2C1=O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CTDSP1 Q9GZU7 1/20 0.43
▸ TYMS P04818 3/20 0.42
▸ DPP4 P27487 2/20 0.39
▸ ANPEP P15144 1/20 0.39
▸ MYC P01106 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ POLB P06746 2/20 0.34
▸ ELANE P08246 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ MAPT P10636 2/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ LMNA P02545 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
SCHEMBL11020324 0.90 DPP4 (0.41) CTDSP1TYMSDPP4ANPEPELANE
SCHEMBL11019260 0.90 DPP4 (0.39) CTDSP1TYMSDPP4ANPEPELANE
SCHEMBL11017190 0.89 DPP4 (0.46) CTDSP1TYMSDPP4ANPEPMYC
SCHEMBL11019132 0.89 POLB (0.39) TYMSDPP4ANPEPPOLBELANE
SCHEMBL11017185 0.89 HSD17B10 (0.43) CTDSP1TYMSDPP4ANPEPELANE
SCHEMBL11019037 0.85 DPP4 (0.56) CTDSP1TYMSDPP4ANPEPGAA
SCHEMBL11018483 0.84 TYMS (0.43) CTDSP1TYMSDPP4ANPEPMYC
SCHEMBL11017039 0.83 DPP4 (0.47) CTDSP1TYMSDPP4ANPEPGAA
SCHEMBL11019052 0.82 DPP4 (0.51) CTDSP1TYMSDPP4ANPEPGAA
SCHEMBL11021513 0.81 DPP4 (0.48) CTDSP1TYMSDPP4ANPEPGAA

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
Send feedback