SCHEMBL766470

SCHEMBL766470

C=CC(CC)C(=O)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
CYP1A2 P05177 1/20 0.43
THRB P10828 3/20 0.41
ELANE P08246 2/20 0.41
MAPT P10636 3/20 0.41
TDP1 Q9NUW8 2/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.38
MIF P14174 1/20 0.38
FAAH O00519 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
TSHR P16473 1/20 0.37
HPGD P15428 1/20 0.37
PIN1 Q13526 1/20 0.36
ESR1 P03372 1/20 0.36
HIF1A Q16665 1/20 0.36

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
SCHEMBL29222836 0.91 MAPT (0.48) L3MBTL1CYP1A2ELANEMAPTTDP1
SCHEMBL27456541 0.85 ATM (0.46) ATML3MBTL1CYP1A2THRBELANE
SCHEMBL27775013 0.83 ATM (0.45) ATML3MBTL1CYP1A2THRBELANE
SCHEMBL3935982 0.82 ZDHHC2 (0.47) THRBTDP1ALDH1A1FAAHZDHHC2
SCHEMBL17354690 0.81 ELANE (0.43) ATML3MBTL1CYP1A2THRBELANE
SCHEMBL16672924 0.80 MAPT (0.43) L3MBTL1CYP1A2MAPTTDP1MEN1
SCHEMBL616964 0.79 ALDH1A1 (0.51) L3MBTL1ELANEMAPTTDP1KMT2A
SCHEMBL16672956 0.78 L3MBTL1 (0.47) L3MBTL1MAPTTDP1KMT2AALDH1A1
SCHEMBL27442266 0.78 ATM (0.43) ATML3MBTL1CYP1A2THRBELANE
SCHEMBL27918124 0.78 ATM (0.43) ATML3MBTL1CYP1A2THRBELANE

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
CN-105175315-B Photo-corrosion-resisting agent composition 巴斯夫欧洲公司 2018-08-28 CN disclosed
US-8835099-B2 Lithographic printing plate precursor EASTMAN KODAK COMPANY (US) 2014-09-16 US disclosed
US-20120070779-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR QUALEX INC. 2012-03-22 US disclosed