SCHEMBL3345863

SCHEMBL3345863

CCCCCCCCCCCCCCCCCNC=CCN

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.52
ADH1B P00325 2/20 0.52
ADH1C P00326 2/20 0.52
ADH1A P07327 2/20 0.52
ADH7 P40394 2/20 0.52
ADH4 P08319 1/20 0.52
PPARA Q07869 1/20 0.39
DNM1 Q05193 8/20 0.39
ALDH1A1 P00352 2/20 0.39
TSHR P16473 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SLC6A5 Q9Y345 1/20 0.37

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
SCHEMBL3232096 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL8162519 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL4000116 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL9807858 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL3222859 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL3232423 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL4006536 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL2038166 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL4006538 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7
SCHEMBL4000190 1.00 EPHX1 (0.52) EPHX1ADH1BADH1CADH1AADH7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100105590-A1 LUBRICATING OIL COMPOSITION SHOWA SHELL SEKIYU K.K. (JP) 2010-04-29 US disclosed
US-20090318320-A1 Lubricating Oil Composition SHOWA SHELL SEKIYU K.K. (JP) 2009-12-24 US disclosed
EP-2109657-A1 LUBRICATING OIL COMPOSITION Showa Shell Sekiyu K. K. (JP) 2009-10-21 EP disclosed
EP-2074202-A2 LUBRICATING OIL COMPOSITION Showa Shell Sekiyu K. K. (JP) 2009-07-01 EP disclosed
WO-2008095966-A1 LUBRICATING OIL COMPOSITION SHOWA SHELL SEKIYU K.K. (JP) 2008-08-14 WO disclosed
WO-2008031808-A2 LUBRICATING OIL COMPOSITION AN ASPARTIC ACID DERIVATIVE AND A FATTY ESTER OF A POLYHYDRIC ALCOHOL SHOWA SHELL SEKIYU K.K. (JP) 2008-03-20 WO disclosed