SCHEMBL11210600

SCHEMBL11210600

C(=Cc1ccc(CCOc2ccccc2)cc1)Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.50
PPARA Q07869 2/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
FFAR1 O14842 1/20 0.49
LTA4H P09960 1/20 0.48
S1PR1 P21453 5/20 0.47
S1PR3 Q99500 3/20 0.47
HPGD P15428 1/20 0.46
GAA P10253 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
DRD2 P14416 1/20 0.44
DRD4 P21917 1/20 0.44
DRD3 P35462 1/20 0.44
LCK P06239 1/20 0.43

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
SCHEMBL20024693 0.83 NPC1 (0.65) PPARGPPARANPC1RAB9AFFAR1
SCHEMBL1070131 0.79 NPC1 (0.73) NPC1RAB9AFFAR1LTA4HGAA
SCHEMBL14691485 0.79 LCK (0.62) PPARGNPC1RAB9AGAALCK
SCHEMBL6546753 0.77 MAOB (0.48) LTA4HHPGDCA1CA2
SCHEMBL5175852 0.77 FFAR1 (0.63) PPARGPPARANPC1RAB9AFFAR1
Methane SCHEMBL28866356 0.75 NPC1 (0.68) NPC1RAB9AFFAR1LTA4HGAA
SCHEMBL4256257 0.75 MAOB (0.67) LTA4HCA1CA2
SCHEMBL1892917 0.75 MAOB (0.67) LTA4HCA1CA2
SCHEMBL163963 0.75 MAOB (0.67) LTA4HCA1CA2
SCHEMBL9456979 0.75 NPC1 (0.80) NPC1RAB9AFFAR1LTA4HGAA

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
US-4416974-A Radiation curable ceramic pigment composition HERCULES INCORPORATED (US) 1983-11-22 US disclosed
US-4306012-A Process of radiation and heat treatment of printing medium HERCULES INCORPORATED (US) 1981-12-15 US disclosed