SCHEMBL16601805

SCHEMBL16601805

CCc1cccc(C)c1N1C(=O)c2cc(Cl)c3c4c(Cl)cc5c6c(cc(Cl)c(c7c(Cl)cc(c2c37)C1=O)c64)C(=O)N(C(CC)CO)C5=O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 5/20 0.40
ANPEP P15144 4/20 0.40
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
P2RX7 Q99572 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HSD17B10 Q99714 2/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
KCNJ5 P48544 3/20 0.32
KCNJ3 P48549 3/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31

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
SCHEMBL12629126 0.89 DPP4 (0.45) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL15764232 0.85 DPP4 (0.42) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL16601644 0.84 DPP4 (0.47) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL16601636 0.83 DPP4 (0.41) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL12657845 0.82 ANPEP (0.52) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL16601823 0.82 ANPEP (0.38) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL16601640 0.81 DPP4 (0.39) DPP4ANPEPMEN1KMT2A
SCHEMBL16601987 0.81 DPP4 (0.39) DPP4ANPEPMEN1KMT2A
SCHEMBL16656207 0.81 DPP4 (0.43) DPP4ANPEPMEN1KMT2AALDH1A1
SCHEMBL16601825 0.81 DPP4 (0.43) 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-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed