SCHEMBL28065647

SCHEMBL28065647

NC(=O)Oc1ccc(F)c(NC(N)C=O)c1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KIF11 P52732 1/20 0.34
KDR P35968 1/20 0.32
FAAH O00519 2/20 0.32
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL28065646 0.72 MEN1 (0.43) MEN1KMT2ANPC1RAB9ANPSR1
SCHEMBL28007548 0.71 MEN1 (0.42) MEN1KMT2AKIF11
SCHEMBL30063441 0.71 MEN1 (0.57) MEN1KMT2ANPC1RAB9ANPSR1
SCHEMBL5265818 0.71 MEN1 (0.57) MEN1KMT2ANPC1RAB9ANPSR1
SCHEMBL28419275 0.69 MEN1 (0.50) MEN1KMT2ANPC1RAB9ANPSR1
SCHEMBL27602806 0.69 KMT2A (0.53) MEN1KMT2ANPC1RAB9ANPSR1
SCHEMBL29250971 0.69 MEN1 (0.53) MEN1KMT2ANPC1RAB9AKIF11
SCHEMBL4311410 0.69 MEN1 (0.53) MEN1KMT2AKIF11MAPT
SCHEMBL27700665 0.68 MEN1 (0.48) MEN1KMT2ANPC1RAB9ANPSR1
SCHEMBL19810305 0.67 MEN1 (0.52) MEN1KMT2ANPC1RAB9AKIF11

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
CN-105682656-B Compositions and methods for modulating farnesoid X receptors 诺华股份有限公司 2019-11-05 CN disclosed
CN-105682656-A Compositions and methods for modulating farnesoid x receptors 诺华股份有限公司 2016-06-15 CN disclosed