SCHEMBL11233255

SCHEMBL11233255

O=C(O)C(Oc1ccc(CCNc2ccc(Cl)cc2)cc1)C1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.48
EPHX1 P07099 1/20 0.47
ALDH1A1 P00352 1/20 0.44
CASP1 P29466 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PPARG P37231 6/20 0.44
PPARA Q07869 5/20 0.44
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 1/20 0.41
CNR1 P21554 1/20 0.41
FPR2 P25090 1/20 0.41
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CTSS P25774 1/20 0.40

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
SCHEMBL11236871 0.88 EPHX2 (0.52) EPHX2EPHX1ALDH1A1CASP1HSD17B10
SCHEMBL11241423 0.88 EPHX1 (0.44) EPHX2EPHX1ALDH1A1CASP1HSD17B10
SCHEMBL9216152 0.85 NPC1 (0.55) EPHX2EPHX1ALDH1A1CASP1HSD17B10
SCHEMBL11233123 0.79 EPHX2 (0.42) EPHX2EPHX1ALDH1A1MEN1KMT2A
SCHEMBL11382273 0.74 NPC1 (0.52) EPHX2EPHX1ALDH1A1PPARGPPARA
SCHEMBL11233259 0.71 SMN1; SMN2 (0.51) EPHX1NPC1RAB9ALMNAHPGD
SCHEMBL10110920 0.70 METAP2 (0.47) EPHX1ALDH1A1NPC1RAB9AMEN1
SCHEMBL8403428 0.70 METAP2 (0.47) EPHX1ALDH1A1NPC1RAB9AMEN1
SCHEMBL11356710 0.69 HAO1 (0.46) ALDH1A1CASP1NPC1RAB9AMEN1
SCHEMBL21057117 0.69 LDHA (0.54) EPHX1ALDH1A1PPARGPPARANPC1

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