SCHEMBL311508

SCHEMBL311508

Cc1ccc(C(C)(C)C)c(O)c1C=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.47
GABRB2 P47870 1/20 0.47
CA2 P00918 3/20 0.43
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 3/20 0.38
POLB P06746 1/20 0.38
TYR P14679 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GABBR2 O75899 1/20 0.37
GABBR1 Q9UBS5 1/20 0.37
CYP3A4 P08684 2/20 0.36
MAPT P10636 2/20 0.36
TSHR P16473 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL1823720 0.84 GABRA1 (0.50) GABRA1GABRB2CA2CYP1A2CYP2C9
SCHEMBL1823721 0.84 GABRA1 (0.50) GABRA1GABRB2CA2CYP1A2CYP2C9
SCHEMBL1678604 0.83 AR (0.37) CYP3A4MAPTPADI4ERN1
SCHEMBL29397237 0.79 CYP3A4 (0.42) CYP1A2CYP2C9CYP2C19ALDH1A1POLB
SCHEMBL3966986 0.79 CYP3A4 (0.42) CYP1A2CYP2C9CYP2C19ALDH1A1POLB
SCHEMBL6346480 0.76 GABRA1 (0.32) GABRA1GABRB2ALDH1A1TSHR
SCHEMBL4650198 0.75 CYP3A4 (0.44) CYP1A2ALDH1A1POLBSMN1; SMN2CYP3A4
SCHEMBL3461711 0.74 GABRA1 (0.64) GABRA1GABRB2CA2CYP1A2CYP2C9
SCHEMBL8936229 0.74 GABRA1 (0.31) GABRA1GABRB2ALDH1A1TSHRPTGS1
SCHEMBL1825677 0.74 PTGS1 (0.50) PTGS1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2960303-B1 INK COMPOSITION, INKJET RECORDING METHOD, PRINTED MATTER, AND HIGH-MOLECULAR-WEIGHT POLYMERIZATION INITIATOR FUJIFILM CORP (JP) 2019-10-09 EP disclosed
US-9902865-B2 Ink composition, inkjet recording method, printed matter, and high-molecular-weight polymerization initiator FUJIFILM CORPORATION (JP) 2018-02-27 US disclosed
EP-2960303-A1 INK COMPOSITION, INKJET RECORDING METHOD, PRINTED MATTER, AND HIGH-MOLECULAR-WEIGHT POLYMERIZATION INITIATOR Fujifilm Corporation (JP) 2015-12-30 EP disclosed
US-20150344711-A1 INK COMPOSITION, INKJET RECORDING METHOD, PRINTED MATTER, AND HIGH-MOLECULAR-WEIGHT POLYMERIZATION INITIATOR FUJIFILM CORPORATION (JP) 2015-12-03 US disclosed
CN-104995266-A Ink composition, ink jet recording method, printed matter, and polymer polymerization initiator FUJIFILM CORP 2015-10-21 CN disclosed
US-8093349-B2 Terminally modified polybranched polyimide, metal-plated terminally modified polybranched polyimide, and method for producing the same UBE INDUSTRIES, LTD. (JP) 2012-01-10 US disclosed
EP-2097388-B1 NOVEL 2-(2-HYDROXYPHENYL)BENZIMIDAZOLES USEFUL FOR TREATING OBESITY AND DIABETES HIGH POINT PHARMACEUTICALS LLC (US) 2011-09-07 EP disclosed
US-7915299-B2 2-(2-hydroxyphenyl)benzimidazoles useful for treating obesity and diabetes HIGH POINT PHARMACEUTICALS, LLC (US) 2011-03-29 US disclosed
US-20100063122-A1 NOVEL 2-(2-HYDROXYPHENYL)BENZIMlDAZOLES USEFUL FOR TREATING OBESITY AND DIABETES HIGH POINT PHARMACEUTICALS, LLC 2010-03-11 US disclosed
US-20100009206-A1 TERMINALLY MODIFIED POLYBRANCHED POLYIMIDE, METAL-PLATED TERMINALLY MODIFIED POLYBRANCHED POLYIMIDE, AND METHOD FOR PRODUCING THE SAME UBE INDUSTRIES, LTD. (JP) 2010-01-14 US disclosed
EP-2097388-A1 NOVEL 2-(2-HYDROXYPHENYL)BENZIMIDAZOLES USEFUL FOR TREATING OBESITY AND DIABETES High Point Pharmaceuticals, LLC (US) 2009-09-09 EP disclosed
WO-2008059026-A1 NOVEL 2-(2-HYDROXYPHENYL)BENZIMIDAZOLES USEFUL FOR TREATING OBESITY AND DIABETES HIGH POINT PHARMACEUTICALS, LLC (US) 2008-05-22 WO 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-20100063122-A1 NOVEL 2-(2-HYDROXYPHENYL)BENZIMlDAZOLES USEFUL FOR TREATING OBESITY AND DIABETES GPR119, HAGH, ALDH2 GABRA1 1185/4885GABRB2 424/4885CA2 1557/4885

“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.