SCHEMBL11233259

SCHEMBL11233259

CC(NC(=O)c1ccc(Cl)cc1)c1ccc(OC(C(=O)O)C2CCCCC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.51
NPSR1 Q6W5P4 1/20 0.51
HPGD P15428 2/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
GAA P10253 1/20 0.46
PTGER4 P35408 2/20 0.46
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
IDO1 P14902 1/20 0.43
EPHX1 P07099 3/20 0.43
LMNA P02545 1/20 0.43
ACACB O00763 2/20 0.42
GPR139 Q6DWJ6 1/20 0.42
PTGER2 P43116 1/20 0.42
CCR1 P32246 1/20 0.41
NR1H4 Q96RI1 1/20 0.41

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
SCHEMBL11241426 0.88 SMN1; SMN2 (0.47) SMN1; SMN2NPSR1HPGDNPC1RAB9A
SCHEMBL11236872 0.88 SMN1; SMN2 (0.47) SMN1; SMN2NPSR1HPGDNPC1RAB9A
SCHEMBL9216152 0.78 NPC1 (0.55) SMN1; SMN2NPSR1HPGDNPC1RAB9A
SCHEMBL11246292 0.77 LMNA (0.48) SMN1; SMN2HPGDNPC1RAB9ALMNA
SCHEMBL11237830 0.76 HPGD (0.44) SMN1; SMN2HPGDGAAPTGER4TAS1R3
SCHEMBL10338889 0.74 UTS2R (0.64) SMN1; SMN2NPC1RAB9APTGER4TAS1R3
SCHEMBL23130344 0.74 IDO1 (0.58) SMN1; SMN2TAS1R3TAS1R1IDO1EPHX1
SCHEMBL1922928 0.72 SMN1; SMN2 (0.71) SMN1; SMN2NPC1GAALMNAGPR139
SCHEMBL7676189 0.72 SMN1; SMN2 (0.71) SMN1; SMN2NPC1GAALMNAGPR139
SCHEMBL31498841 0.72 GPR139 (0.72) SMN1; SMN2HPGDNPC1GAALMNA

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-4318923-A HYPOLIPEMIC AGENT KAKEN CHEMICAL CO., LTD. (JP) 1982-03-09 US disclosed