SCHEMBL18620676

SCHEMBL18620676

COC(=O)[C@@H]1CCCN1C(=O)CNC(=O)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PREP P48147 7/20 0.68
▸ DPP4 P27487 4/20 0.50
▸ NPC1 O15118 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ EPHX2 P34913 3/20 0.46
▸ FAAH O00519 1/20 0.46
▸ TAOK1 Q7L7X3 1/20 0.46
▸ TAOK3 Q9H2K8 1/20 0.46
▸ FAP Q12884 2/20 0.45
▸ TRPV1 Q8NER1 1/20 0.45
▸ ACE P12821 1/20 0.45
▸ NR1H4 Q96RI1 1/20 0.44
▸ HRH3 Q9Y5N1 1/20 0.44
▸ PDE4B Q07343 1/20 0.44
▸ PDE4D Q08499 1/20 0.44
▸ KDM2B Q8NHM5 1/20 0.44
▸ DPP8 Q6V1X1 1/20 0.43
▸ DPP9 Q86TI2 1/20 0.43
▸ PDK2 Q15119 1/20 0.43

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
SCHEMBL22811419 1.00 PREP (0.68) PREPDPP4NPC1GAARAB9A
SCHEMBL26563985 0.86 DPP4 (0.53) PREPDPP4NPC1GAARAB9A
SCHEMBL22811118 0.84 ALDH1A1 (0.55) PREPDPP4FAPACEDPP8
SCHEMBL22811227 0.81 DPP4 (0.59) PREPDPP4FAPACEDPP8
SCHEMBL22811334 0.80 PREP (0.66) PREPDPP4GAARAB9AFAP
SCHEMBL22209472 0.79 DPP4 (0.62) PREPDPP4NPC1GAARAB9A
SCHEMBL18620672 0.79 ELANE (0.53) PREP
SCHEMBL22209446 0.79 ELANE (0.53) PREP
SCHEMBL22209388 0.78 PREP (0.58) PREPDPP4NPC1GAARAB9A
SCHEMBL13739448 0.77 EPHX2 (0.68) GAAEPHX2

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
WO-2017040304-A1 MALT1 INHIBITORS AND USES THEREOF CORNELL UNIVERSITY (US) 2017-03-09 — — WO disclosed
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