SCHEMBL7732428

SCHEMBL7732428

N[C@H](CCc1ccc(F)cc1)C(O)c1nc2cnccc2o1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 1/20 0.36
AAK1 Q2M2I8 5/20 0.35
RAB9A P51151 1/20 0.34
CYP19A1 P11511 3/20 0.32
C3AR1 Q16581 1/20 0.32
MAPK14 Q16539 1/20 0.31
ROCK2 O75116 1/20 0.31
GRM2 Q14416 1/20 0.31
SORD Q00796 1/20 0.31
PTPN1 P18031 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
SCHEMBL7735914 0.78 S1PR1 (0.40) DAGLAAAK1RAB9AGRM2PTPN1
SCHEMBL5431040 0.74 FAAH (0.42) DAGLARAB9A
SCHEMBL7732346 0.74 FAAH (0.42) DAGLARAB9A
SCHEMBL6462278 0.74 FAAH (0.42) DAGLARAB9A
SCHEMBL7561710 0.74 FAAH (0.42) DAGLARAB9A
SCHEMBL7732480 0.71 HSD17B10 (0.41) DAGLAAAK1RAB9A
SCHEMBL7858147 0.69 XDH (0.46) RAB9A
SCHEMBL7736136 0.69 XDH (0.46) RAB9A
SCHEMBL7729637 0.68 METAP2 (0.41) RAB9A
SCHEMBL7732448 0.68 METAP2 (0.38) RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6436980-B1 TRANSPORT PROTEIN SUPPRESSORS; MICROBIOCIDES ESSENTIAL THERAPEUTICS, INC. 2002-08-20 US disclosed