SCHEMBL11021331

SCHEMBL11021331

COC(=O)c1cccc2c1C(=O)N(c1c(C)cc(Br)cc1C)C2=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 3/20 0.46
▸ POLB P06746 1/20 0.45
▸ SLC6A3 Q01959 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ TYMS P04818 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ MAPK10 P53779 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PTK2B Q14289 1/20 0.40
▸ NCOA1 Q15788 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ NCOA3 Q9Y6Q9 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ GLA P06280 1/20 0.39

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
SCHEMBL11018293 0.85 DPP4 (0.48) DPP4TYMSMAPTANPEPGRM4
SCHEMBL11017877 0.80 DPP4 (0.48) DPP4POLBALDH1A1HPGDL3MBTL1
SCHEMBL11017664 0.79 ANPEP (0.52) DPP4POLBSLC6A3ALDH1A1HPGD
SCHEMBL11018659 0.79 DPP4 (0.55) DPP4POLBALDH1A1HPGDTYMS
SCHEMBL11022176 0.79 DPP4 (0.63) DPP4POLBALDH1A1HPGDL3MBTL1
SCHEMBL11019298 0.78 DPP4 (0.52) DPP4POLBALDH1A1HPGDL3MBTL1
SCHEMBL11020066 0.78 DPP4 (0.64) DPP4POLBHTTMAPTMEN1
SCHEMBL11018018 0.77 DPP4 (0.42) DPP4POLBALDH1A1HPGDL3MBTL1
SCHEMBL11019712 0.76 ANPEP (0.52) DPP4POLBSLC6A3ALDH1A1HPGD
SCHEMBL11020240 0.74 DPP4 (0.50) DPP4TYMSSMN1; SMN2ANPEP

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