SCHEMBL28307828

SCHEMBL28307828

C=CCc1cccc(C)c1-c1ccc(O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.47
GABRA1 P14867 3/20 0.46
GABRB2 P47870 3/20 0.46
ESR1 P03372 3/20 0.43
ESR2 Q92731 3/20 0.43
GAA P10253 4/20 0.43
SENP1 Q9P0U3 1/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
MAPT P10636 3/20 0.35
MAPK1 P28482 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MGAM O43451 2/20 0.35
SI P14410 2/20 0.35
MGAM2 Q2M2H8 2/20 0.35
MAP2K4 P45985 1/20 0.35
MAPKAPK2 P49137 1/20 0.35
MAPK6 Q16659 1/20 0.35
POLB P06746 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
SCHEMBL10458143 0.81 SENP1 (0.45) ESR1ESR2GAASENP1MEN1
SCHEMBL9258199 0.78 AKR1B1 (0.45) AKR1B1GABRA1GABRB2ESR1ESR2
SCHEMBL21811722 0.77 ESR1 (0.45) ESR1ESR2GAASENP1MAPK1
SCHEMBL29032547 0.77 GABRA1 (0.73) AKR1B1GABRA1GABRB2ESR1ESR2
SCHEMBL6288837 0.76 SENP1 (0.56) ESR1ESR2GAASENP1MEN1
SCHEMBL722558 0.75 GABRA1 (0.66) AKR1B1GABRA1GABRB2GAAMEN1
Phenol SCHEMBL28322043 0.75 GABRA1 (0.56) AKR1B1GABRA1GABRB2ESR1ESR2
Phenol SCHEMBL27750026 0.75 ESR1 (0.51) AKR1B1GABRA1GABRB2ESR1ESR2
SCHEMBL28185003 0.74 PTPN1 (0.46) ESR1ESR2SENP1MEN1KMT2A
SCHEMBL27677647 0.73 GABRA1 (0.56) AKR1B1GABRA1GABRB2ESR1ESR2

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
CN-112384552-A Polyphenylene ether, curable composition containing polyphenylene ether, dry film, prepreg, cured product, laminate, and electronic component 太阳控股株式会社 2021-02-19 CN disclosed
CN-110003582-A Heat resistance styrene resin composite, molded product, extrusion sheet and food packaging container 东洋苯乙烯股份有限公司 2019-07-12 CN disclosed