SCHEMBL2306875

SCHEMBL2306875

OCCc1cc2ccc(CCO)c3c4cccc5cccc(c(c1)c23)c54

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.39
ERBB2 P04626 1/20 0.39
FYN P06241 1/20 0.39
MAOA P21397 1/20 0.39
ACHE P22303 1/20 0.39
AHR P35869 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
TDP1 Q9NUW8 2/20 0.34
KDM4E B2RXH2 2/20 0.34
CYP2D6 P10635 2/20 0.32
CYP2C19 P33261 1/20 0.32
CHEK1 O14757 1/20 0.30
GLA P06280 1/20 0.30
POLB P06746 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL2311140 1.00 CYP1A2 (0.39) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL2309246 0.96 CYP1A2 (0.40) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL2312283 0.88 ALDH1A1 (0.48) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL2311215 0.88 CYP1A2 (0.40) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL2309839 0.86 TDP1 (0.40) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL2312322 0.86 TDP1 (0.40) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL2310398 0.85 MEN1 (0.37) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL2310224 0.85 MEN1 (0.37) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL2310441 0.85 CYP1A2 (0.39) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL2314747 0.84 ALDH1A1 (0.46) CYP1A2ERBB2FYNMAOAACHE

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-7989517-B2 Actinic ray curable composition, actinic ray curable ink, and image formation process employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2011-08-02 US disclosed
US-20070123600-A1 ACTINIC RAY CURABLE COMPOSITION, ACTINIC RAY CURABLE INK, AND IMAGE FORMATION PROCESS EMPLOYING THE SAME KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-05-31 US disclosed