SCHEMBL18535902

SCHEMBL18535902

COc1cc2c(c(OC)c1OC)Cc1c(cc(OC)c(OC)c1OC)C2

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
CYP3A4 P08684 2/20 0.56
TDP1 Q9NUW8 2/20 0.54
LMNA P02545 1/20 0.54
POLB P06746 1/20 0.54
ATM Q13315 2/20 0.48
ACHE P22303 2/20 0.43
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
DRD1 P21728 1/20 0.42
CA9 Q16790 1/20 0.41
ALOX5 P09917 1/20 0.41
ADORA1 P30542 1/20 0.40
PTGS2 P35354 1/20 0.39

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
SCHEMBL11356640 0.80 ATM (0.66) MAPTCYP3A4TDP1LMNAPOLB
SCHEMBL14823523 0.77 LMNA (0.57) MAPTCYP3A4TDP1LMNAPOLB
SCHEMBL10792005 0.74 NQO2 (0.45) MAPTCYP3A4TDP1LMNAPOLB
SCHEMBL2138785 0.73 CYP3A4 (1.00) MAPTCYP3A4ACHEKDM4EDRD1
SCHEMBL29394312 0.73 CYP3A4 (1.00) MAPTCYP3A4ACHEKDM4EDRD1
SCHEMBL25591699 0.73 CYP3A4 (0.78) MAPTCYP3A4ATMACHEKDM4E
SCHEMBL4571013 0.73 CYP3A4 (1.00) MAPTCYP3A4ACHEKDM4EDRD1
SCHEMBL29460958 0.73 CYP3A4 (0.78) MAPTCYP3A4ATMACHEKDM4E
SCHEMBL22953335 0.73 CYP3A4 (1.00) MAPTCYP3A4ACHEKDM4EDRD1
SCHEMBL18537279 0.72 CYP3A4 (0.48) MAPTCYP3A4TDP1LMNAPOLB

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
EP-3141958-A2 CHEMICALLY AMPLIFIED RESIST MATERIAL AND RESIST PATTERN-FORMING METHOD JSR Corporation (JP) 2017-03-15 EP disclosed
EP-3133444-A1 CHEMICALLY AMPLIFIED RESIST MATERIAL, PATTERN-FORMING METHOD, COMPOUND, AND PRODUCTION METHOD OF COMPOUND OSAKA UNIVERSITY (JP) 2017-02-22 EP disclosed