SCHEMBL9732297

SCHEMBL9732297

C=C=CC(=O)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.50
CES2 O00748 1/20 0.50
AKR1B1 P15121 1/20 0.50
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CTBP2 P56545 1/20 0.41
EPHX2 P34913 1/20 0.41
PAM P19021 2/20 0.40
FFAR1 O14842 1/20 0.40
TSHR P16473 2/20 0.39
ABCC4 O15439 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
SCHEMBL669706 0.77 CES1 (0.56) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL31536254 0.77 CES1 (0.42) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL26691604 0.76 CYP3A4 (0.47) CES1CES2AKR1B1MEN1KMT2A
Ammonia Solution, Strong SCHEMBL11111905 0.75 CES1 (0.54) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL25169 0.74 CES1 (0.58) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL27263026 0.74 CES1 (0.58) CES1CES2AKR1B1MEN1KMT2A
Oxalic Acid SCHEMBL29268820 0.73 CES1 (0.52) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL29061794 0.73 CES1 (0.47) CES1CES2AKR1B1MEN1KMT2A
Bicarbonate SCHEMBL10938525 0.72 CES1 (0.56) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL7874216 0.72 CES1 (0.56) CES1CES2AKR1B1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107011145-B Method for preparing 2-iodopent-2-ene-1, 4-dione derivative by visible light catalysis 浙江工业大学 2020-08-21 CN disclosed
CN-107721917-B Green synthesis method of polysubstituted nicotinate compound 河南理工大学 2020-07-10 CN disclosed
CN-102228453-B The application in preparation chemical pain and/or immune injury of two (aminoalkoxide) the phenyl pentadienone compounds 温州医学院 2016-07-06 CN disclosed
CN-102228453-B The application in preparation chemical pain and/or immune injury of two (aminoalkoxide) the phenyl pentadienone compounds 温州医学院 2016-07-06 CN disclosed
US-5112440-A METHOD FOR MAKING METALLIC PATTERNS CIBA-GEIGY CORPORATION (US) 1992-05-12 US disclosed
EP-0425437-A2 Method for making metallic patterns CIBA-GEIGY AG (CH) 1991-05-02 EP disclosed
EP-0294325-A2 Process of making a metallic pattern CIBA-GEIGY AG (CH) 1988-12-07 EP disclosed
EP-0115471-B1 IMAGE-FORMING PROCESS CIBA-GEIGY AG (CH) 1988-02-10 EP disclosed
US-4546067-A Image production utilizing multifunctional light sensitive compounds CIBA GEIGY CORPORATION (US) 1985-10-08 US disclosed
EP-0115471-A2 Image-forming process CIBA-GEIGY AG (CH) 1984-08-08 EP disclosed