SCHEMBL19612419

SCHEMBL19612419

CC(C)Oc1c(Oc2ccccc2)cc2ccccc2c1OC(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.41
MAPT P10636 4/20 0.39
ATM Q13315 1/20 0.39
TLR8 Q9NR97 1/20 0.39
KDM4E B2RXH2 2/20 0.39
GLA P06280 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NTRK1 P04629 1/20 0.37
NTRK3 Q16288 1/20 0.37
NTRK2 Q16620 1/20 0.37
NQO1 P15559 1/20 0.37
ACP1 P24666 1/20 0.36
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35

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
SCHEMBL19612184 0.83 NQO1 (0.46) IRAK4MAPTTLR8KDM4ECYP1A2
SCHEMBL19612255 0.82 NQO1 (0.44) MAPTKDM4EGLAKMT2ANQO1
SCHEMBL19612469 0.79 NTRK1 (0.40) IRAK4MAPTATMTLR8KDM4E
SCHEMBL19612334 0.78 MCL1 (0.41) IRAK4MAPTKMT2ACYP1A2CYP2C9
SCHEMBL10553536 0.77 TLR8 (0.44) IRAK4MAPTATMTLR8CYP1A2
SCHEMBL19612292 0.75 LTA4H (0.47) MAPTTLR8KDM4EGLAKMT2A
SCHEMBL19612509 0.75 CYP1A2 (0.42) IRAK4MAPTATMTLR8KDM4E
SCHEMBL9192346 0.74 NQO1 (0.48) IRAK4MAPTATMTLR8KDM4E
SCHEMBL19612332 0.73 MAPT (0.40) IRAK4MAPTATMTLR8KDM4E
SCHEMBL6745255 0.72 GPR84 (0.49) MAPTKDM4EGLAKMT2ACYP1A2

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-20170336728-A1 ULTRAVIOLET CURABLE LIQUID COMPOSITION, ULTRAVIOLET CURING INKJET INK, ULTRAVIOLET CURING WET ELECTROPHOTOGRAPHIC LIQUID DEVELOPER, ULTRAVIOLET CURING ELECTROSTATIC INKJET INK, AND IMAGE FORMING METHOD USING THEREOF CANON KABUSHIKI KAISHA (JP) 2017-11-23 US disclosed