SCHEMBL17997464

SCHEMBL17997464

Cc1ccc(Nc2ccc(C=C(c3ccccc3)c3ccc(-c4ccc(C=C(c5ccccc5)c5ccc(C)cc5C)cc4)cc3C)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.44
HPGD P15428 2/20 0.40
NFE2L2 Q16236 1/20 0.38
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
RAB9A P51151 3/20 0.37
NPC1 O15118 3/20 0.37
XDH P47989 1/20 0.37
SLC22A12 Q96S37 1/20 0.37
MAPT P10636 5/20 0.36
NPSR1 Q6W5P4 2/20 0.36
JAK2 O60674 1/20 0.36
HTT P42858 1/20 0.36
ATM Q13315 1/20 0.36
GAA P10253 3/20 0.35
G6PD P11413 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
POLB P06746 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL17997460 0.98 PTGS2 (0.41) PTGS2HPGDNFE2L2MEN1KMT2A
SCHEMBL17997456 0.93 PTGS2 (0.39) PTGS2HPGDNFE2L2MEN1KMT2A
SCHEMBL17997454 0.92 RAPGEF4 (0.43) PTGS2NFE2L2MEN1KMT2ARAB9A
SCHEMBL17997446 0.92 MAPT (0.42) PTGS2NFE2L2MEN1KMT2ARAB9A
SCHEMBL17997452 0.86 PTGS2 (0.57) PTGS2HPGDMEN1KMT2ARAB9A
SCHEMBL17997442 0.85 PTGS2 (0.56) PTGS2HPGDMEN1KMT2ARAB9A
SCHEMBL17997449 0.84 PTGS2 (0.48) PTGS2HPGDMEN1KMT2ARAB9A
SCHEMBL17997465 0.83 RAPGEF4 (0.53) PTGS2HPGDMEN1KMT2ARAB9A
SCHEMBL17997476 0.83 PTGS2 (0.49) PTGS2HPGDMEN1KMT2ARAB9A
SCHEMBL2528716 0.80 PTGS2 (0.59) PTGS2HPGDMEN1KMT2ARAB9A

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
US-20160231658-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR AND IMAGE FORMING APPARATUS Konica Minolta, Inc. (JP) 2016-08-11 US disclosed