SCHEMBL28699585

SCHEMBL28699585

C=CCc1cccc2c1C(O)(O)c1ccccc1-2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.51
GABRB2 P47870 1/20 0.51
AKR1B1 P15121 1/20 0.41
PDK2 Q15119 9/20 0.39
GAA P10253 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.35
THRB P10828 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALPL P05186 1/20 0.34
ALPG P10696 1/20 0.34

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
SCHEMBL2899906 0.92 GABRA1 (0.50) GABRA1GABRB2AKR1B1PDK2GAA
SCHEMBL28366154 0.80 GABRA1 (0.47) GABRA1GABRB2AKR1B1PDK2GAA
SCHEMBL10805934 0.76 GABRA1 (0.47) GABRA1GABRB2AKR1B1PDK2GAA
SCHEMBL2909585 0.75 GABRA1 (0.64) GABRA1GABRB2AKR1B1GAAKDM4E
SCHEMBL10796118 0.75 GABRA1 (0.42) GABRA1GABRB2AKR1B1PDK2GAA
SCHEMBL10797065 0.72 GABRA1 (0.40) GABRA1GABRB2AKR1B1PDK2GAA
SCHEMBL4818959 0.72 GABRA1 (0.46) GABRA1GABRB2AKR1B1PDK2GAA
SCHEMBL7237376 0.72 GABRA1 (0.46) GABRA1GABRB2AKR1B1PDK2GAA
SCHEMBL2362466 0.71 GABRA1 (0.61) GABRA1GABRB2AKR1B1GAAKDM4E
SCHEMBL29900352 0.71 GABRA1 (0.61) GABRA1GABRB2AKR1B1GAAKDM4E

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
CN-110268328-B Blue photosensitive resin composition, color filter and image display device manufactured by using the same 东友精细化工有限公司 2022-02-08 CN disclosed