SCHEMBL7046736

SCHEMBL7046736

CCc1cc2cccc(O)c2cc1CC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.50
GRIN2A Q12879 1/20 0.50
GRIN2B Q13224 1/20 0.50
GRIN2C Q14957 1/20 0.50
PLAU P00749 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
CYP1A2 P05177 1/20 0.45
GABRA1 P14867 1/20 0.45
GABRB2 P47870 1/20 0.45
DAO P14920 2/20 0.45
HSD17B1 P14061 6/20 0.43
HSD17B2 P37059 6/20 0.43
ESR1 P03372 2/20 0.43
ESR2 Q92731 2/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
DDO Q99489 1/20 0.41
POLA1 P09884 1/20 0.39
IDO1 P14902 1/20 0.39
TDO2 P48775 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
SCHEMBL7047251 0.87 HSD17B1 (0.47) GRIN2DGRIN2AGRIN2BGRIN2CPLAU
SCHEMBL7046826 0.87 HSD17B1 (0.47) GRIN2DGRIN2AGRIN2BGRIN2CPLAU
SCHEMBL31290149 0.85 GPR84 (0.44) GRIN2DGRIN2AGRIN2BGRIN2CPLAU
SCHEMBL31290197 0.82 TYR (0.47) GRIN2DGRIN2AGRIN2BGRIN2CPLAU
SCHEMBL14536633 0.79 HMGCR (0.49) GRIN2DGRIN2AGRIN2BGRIN2CPLAU
SCHEMBL29857010 0.78 CYP1A2 (0.62) GRIN2DGRIN2AGRIN2BGRIN2CPLAU
SCHEMBL2115683 0.78 CYP1A2 (0.62) GRIN2DGRIN2AGRIN2BGRIN2CPLAU
SCHEMBL7045703 0.77 HSD17B1 (0.45) GRIN2DGRIN2AGRIN2BGRIN2CPLAU
SCHEMBL6343692 0.76 DAO (0.53) GRIN2DGRIN2AGRIN2BGRIN2CGABRA1
SCHEMBL14898176 0.76 CYP1A2 (0.50) GRIN2DGRIN2AGRIN2BGRIN2CPLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1211336-C High-quality bisphenol A and process for producing the same MITSUI CHEMICALS INC (JP) 2005-07-20 CN disclosed
US-20030028055-A1 High quality bisphenol a and preparation process thereof MITSUI CHEMICALS, INC. (JP) 2003-02-06 US disclosed
CN-1345297-A High-quality bisphenol A and process for producing the same MITSUI CHEMICALS INC (JP) 2002-04-17 CN disclosed
EP-1149816-A1 HIGH-QUALITY BISPHENOL A AND PROCESS FOR PRODUCING THE SAME Mitsui Chemicals, Inc. (JP) 2001-10-31 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030028055-A1 High quality bisphenol a and preparation process thereof TET2, PCBP1, PAH GRIN2D 4102/4885GRIN2A 4382/4885GRIN2B 4758/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.