SCHEMBL9502992

SCHEMBL9502992

CCC(C)c1cc(CCCC(C)C)cc(C(=O)O)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
KAT8 Q9H7Z6 2/20 0.39
HMGB1 P09429 1/20 0.38
CXCL12 P48061 1/20 0.38
AKR1C2 P52895 2/20 0.37
AKR1C1 Q04828 2/20 0.37
PPARA Q07869 1/20 0.36
PTPN1 P18031 4/20 0.35
ALOX5 P09917 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33

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
SCHEMBL9501685 0.95 KAT8 (0.43) GRIN2DGRIN2AGRIN2BGRIN2CKAT8
SCHEMBL9500885 0.90 KAT8 (0.43) GRIN2DGRIN2AGRIN2BGRIN2CKAT8
SCHEMBL14135767 0.89 AKR1C2 (0.47) KAT8HMGB1CXCL12AKR1C2AKR1C1
SCHEMBL9504163 0.86 GRIN2D (0.45) GRIN2DGRIN2AGRIN2BGRIN2CKAT8
SCHEMBL8915502 0.82 KAT8 (0.43) GRIN2DGRIN2AGRIN2BGRIN2CKAT8
SCHEMBL9308594 0.82 KAT8 (0.43) GRIN2DGRIN2AGRIN2BGRIN2CKAT8
SCHEMBL15523841 0.81 GRIN2D (0.48) GRIN2DGRIN2AGRIN2BGRIN2CKAT8
SCHEMBL9500669 0.80 GRIN2D (0.47) GRIN2DGRIN2AGRIN2BGRIN2CKAT8
SCHEMBL9700901 0.79 GRIN2D (0.46) GRIN2DGRIN2AGRIN2BGRIN2CKAT8
SCHEMBL9504239 0.78 AKR1C2 (0.45) GRIN2DGRIN2AGRIN2BGRIN2CKAT8

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
EP-0318941-B1 DEVELOPER FOR PRESSURE-SENSITIVE RECORDING SHEETS, AQUEOUS DISPERSION OF THE DEVELOPER AND METHOD FOR PREPARING THE DEVELOPER Sanko Kaihatsu Kagaku Kenkyusho (JP) 1993-06-09 EP claimed