SCHEMBL3978752

SCHEMBL3978752

Cc1cc(Nc2c(C)cccc2C)cc(Nc2c(C)cccc2C)c1C

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 15/20 0.55
ALDH1A1 P00352 1/20 0.46
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PTGS2 P35354 1/20 0.39
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
CXCR2 P25025 1/20 0.36

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
SCHEMBL19087412 0.75 RAPGEF4 (0.71) RAPGEF4ALDH1A1
SCHEMBL2202005 0.74 RAPGEF4 (0.55) RAPGEF4ALDH1A1PTGS2
SCHEMBL3631643 0.74 RAPGEF4 (0.59) RAPGEF4ALDH1A1MEN1KMT2ACXCR2
SCHEMBL4278475 0.74 ALDH1A1 (0.72) RAPGEF4ALDH1A1CXCR2
SCHEMBL1921293 0.72 RAPGEF4 (0.57) RAPGEF4ALDH1A1MEN1KMT2APTGS2
SCHEMBL24237540 0.72 RAPGEF4 (0.57) RAPGEF4PTGS2
SCHEMBL2927525 0.71 ALDH1A1 (0.54) RAPGEF4ALDH1A1PTGS2CXCR2
SCHEMBL8014673 0.70 ALDH1A1 (0.61) RAPGEF4ALDH1A1MEN1KMT2APTGS2
SCHEMBL4800221 0.70 RAPGEF4 (0.55) RAPGEF4ALDH1A1MEN1KMT2APTGS2
SCHEMBL1931619 0.69 NPSR1 (0.63) RAPGEF4ALDH1A1

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
EP-2029706-A2 LUBRICATING COMPOSITIONS CONTAINING ASHLESS CATALYTIC ANTIOXIDANT ADDITIVES ExxonMobil Research and Engineering Company (US) 2009-03-04 EP disclosed
WO-2007133462-A2 LUBRICATING COMPOSITIONS CONTAINING ASHLESS CATALYTIC ANTIOXIDANT ADDITIVES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2007-11-22 WO disclosed