SCHEMBL364546

SCHEMBL364546

Cc1cc([C@](C/C=N/O)(c2ccc(O)cc2)c2ccc(Cl)cc2C)ccn1

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
OPRK1 P41145 2/20 0.31
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
PROKR1 Q8TCW9 1/20 0.31
MAPT P10636 2/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL363467 1.00 MEN1 (0.31) MEN1KMT2AOPRK1OPRM1OPRD1
SCHEMBL363425 0.91 KCNH2 (0.32) PROKR1
SCHEMBL365144 0.91 KCNH2 (0.32) PROKR1
SCHEMBL364470 0.91 CYP19A1 (0.34) PROKR1
SCHEMBL368907 0.88 EHMT2 (0.35) MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL363793 0.81 CYP3A4 (0.35)
SCHEMBL363737 0.81 CYP3A4 (0.35)
SCHEMBL363784 0.80
SCHEMBL364904 0.80 TLR8 (0.38) PROKR1SMN1; SMN2
SCHEMBL362361 0.78 GPBAR1 (0.31)

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-2593426-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F.HOFFMANN-LA ROCHE AG (CH) 2013-05-22 EP claimed
WO-2012007365-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-19 WO claimed