SCHEMBL17997465

SCHEMBL17997465

Cc1ccc(C(=Cc2ccc(-c3ccc(C(=Cc4ccc(Nc5c(C)cc(C)cc5C)cc4)c4ccccc4)cc3)cc2)c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 7/20 0.53
PTGS2 P35354 4/20 0.49
LMNA P02545 2/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
CRHBP P24387 1/20 0.44
KMT2A Q03164 1/20 0.44
CRHR2 Q13324 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HPGD P15428 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ESR1 P03372 1/20 0.38

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
SCHEMBL17997454 0.90 RAPGEF4 (0.43) RAPGEF4PTGS2LMNAMEN1MAPT
SCHEMBL17997453 0.89 RAPGEF4 (0.42) RAPGEF4PTGS2LMNAMEN1MAPT
SCHEMBL17997452 0.88 PTGS2 (0.57) PTGS2MEN1MAPTKMT2AALDH1A1
SCHEMBL17997442 0.87 PTGS2 (0.56) PTGS2MEN1MAPTKMT2AALDH1A1
SCHEMBL17997449 0.86 PTGS2 (0.48) RAPGEF4PTGS2MEN1MAPTKMT2A
SCHEMBL17997476 0.85 PTGS2 (0.49) PTGS2LMNAMEN1MAPTKMT2A
SCHEMBL17997457 0.84 PTGS2 (0.50) PTGS2LMNAMAPTNPSR1SMN1; SMN2
SCHEMBL17997464 0.83 PTGS2 (0.44) PTGS2LMNAMEN1MAPTCRHBP
SCHEMBL2528716 0.82 PTGS2 (0.59) PTGS2MEN1MAPTKMT2AALDH1A1
SCHEMBL13007202 0.82 PTGS2 (0.51) RAPGEF4PTGS2MEN1MAPTKMT2A

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