SCHEMBL16656164

SCHEMBL16656164

CCc1cccc(C)c1N1C(=O)c2cc(-c3c(F)c(F)c(F)c(F)c3F)c3c4c(cc(-c5c(F)c(F)c(F)c(F)c5F)c(c24)C1=O)C(=O)N(C)C3=O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 5/20 0.42
ANPEP P15144 4/20 0.42
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
USP2 O75604 1/20 0.33
CASP1 P29466 1/20 0.33
BRCA1 P38398 1/20 0.33
CASP7 P55210 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
P2RX7 Q99572 1/20 0.32
NPEPPS P55786 1/20 0.32

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
SCHEMBL16656163 0.83 DPP4 (0.44) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL16601640 0.82 DPP4 (0.39) DPP4ANPEPMEN1KMT2A
SCHEMBL16656331 0.80 DPP4 (0.42) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL16656161 0.79 PGR (0.38) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL12656452 0.78 DPP4 (0.50) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL16601611 0.78 ANPEP (0.49) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL12107612 0.77 ALDH1A1 (0.38) MEN1KMT2AALDH1A1POLBUSP2
SCHEMBL16601631 0.74 DPP4 (0.46) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL13045764 0.73 DPP4 (0.55) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL29381488 0.71 DPP4 (0.56) DPP4ANPEPMEN1KMT2AALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US disclosed
US-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US disclosed