SCHEMBL4238441

SCHEMBL4238441

C=CCc1c(O)c(OCc2ccccc2)cc(OCc2ccccc2)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.42
CYP1A2 P05177 2/20 0.42
LMNA P02545 1/20 0.42
PTGS1 P23219 1/20 0.42
SLC6A2 P23975 1/20 0.42
PTGS2 P35354 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HIF1A Q16665 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
LIPE Q05469 1/20 0.41
MAPT P10636 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
CYP2C9 P11712 1/20 0.40
PTPN1 P18031 1/20 0.40
RAB9A P51151 2/20 0.40
ERN1 O75460 1/20 0.40
NPC1 O15118 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
SCHEMBL10689679 0.80 HTR1A (0.48) CYP2C19CYP1A2LMNAPTGS1SLC6A2
SCHEMBL7561778 0.80 CYP2C19 (0.41) CYP2C19CYP1A2LMNAPTGS1SLC6A2
SCHEMBL4238445 0.78 MMP2 (0.43) SMN1; SMN2RAB9A
SCHEMBL30705310 0.77 GABRA1 (0.51) LMNALIPEMAPTTDP1L3MBTL1
SCHEMBL2030039 0.77 ALDH1A1 (0.60) LMNAPTGS1MAPTTDP1L3MBTL1
SCHEMBL12635300 0.77 GABRA1 (0.51) LMNALIPEMAPTTDP1L3MBTL1
SCHEMBL9194110 0.76 MAPT (0.42) CYP2C19CYP1A2MAPTTDP1L3MBTL1
SCHEMBL14283740 0.76 CYP2C19 (0.53) CYP2C19CYP1A2LMNAPTGS1SLC6A2
SCHEMBL8464740 0.76 MAPT (0.64) CYP2C19CYP1A2LMNAMAPTTDP1
SCHEMBL4012665 0.75 CYP1A2 (0.50) CYP2C19CYP1A2LMNAPTGS1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0896963-B1 Methyl oxirane dibenzoylresorcinol UV absorbers MOMENTIVE PERFORMANCE MAT INC (US) 2009-10-21 EP disclosed
US-5959012-A COMPATIBILITY, SOLUBILITY, LOWER VOLATILITY, HIGHER MOLECULAR WEIGHT GENERAL ELECTRIC COMPANY (US) 1999-09-28 US disclosed
EP-0896963-A1 Methyl oxirane dibenzoylresorcinol UV absorbers GENERAL ELECTRIC COMPANY (US) 1999-02-17 EP disclosed