SCHEMBL365048

SCHEMBL365048

C/C(=N/O)[C@@](c1ccc(O)cc1)(c1ccnc(C)c1)c1ccc(Cl)cc1C

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
OPRK1 P41145 2/20 0.31
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
PROKR1 Q8TCW9 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
SCHEMBL363756 1.00 MEN1 (0.32) MEN1KMT2AMAPTSMN1; SMN2OPRK1
SCHEMBL363413 0.90 POLB (0.30)
SCHEMBL363100 0.90 POLB (0.30)
SCHEMBL362836 0.90 POLB (0.30)
SCHEMBL363109 0.90 CASR (0.34) SMN1; SMN2PROKR1
SCHEMBL364569 0.86 MAPT (0.36) MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL365288 0.86 CCR9 (0.34)
SCHEMBL363868 0.86 CCR9 (0.34)
SCHEMBL364634 0.86 PROKR1 (0.35) MEN1KMT2AMAPTSMN1; SMN2PROKR1
SCHEMBL364263 0.85 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 disclosed
WO-2012007365-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-19 WO disclosed