SCHEMBL4397432

SCHEMBL4397432

COC(=O)c1cc(C(C)(C)c2ccc(O)cc2)ccc1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 6/20 0.65
CA1 P00915 6/20 0.65
CA2 P00918 6/20 0.65
CA7 P43166 6/20 0.65
CA9 Q16790 6/20 0.65
CA14 Q9ULX7 6/20 0.65
PDK2 Q15119 1/20 0.51
PDK4 Q16654 1/20 0.51
ESR1 P03372 4/20 0.50
ESR2 Q92731 3/20 0.50
TSHR P16473 2/20 0.50
CYP3A4 P08684 2/20 0.50
AR P10275 1/20 0.50
HPGD P15428 1/20 0.50
SLC6A2 P23975 1/20 0.50
SLC6A4 P31645 1/20 0.50
HTR6 P50406 1/20 0.50
ESRRG P62508 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL13609957 0.95 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL4395924 0.88 CA1 (0.53) CA12CA1CA2CA7CA9
SCHEMBL4395058 0.85 EGFR (0.48) CA12CA1CA2CA7CA9
SCHEMBL4541202 0.84 CA12 (0.49) CA12CA1CA2CA7CA9
SCHEMBL9017666 0.84 CA12 (0.68) CA12CA1CA2CA7CA9
SCHEMBL29637890 0.83 CA12 (0.62) CA12CA1CA2CA7CA9
SCHEMBL648753 0.83 CA12 (0.62) CA12CA1CA2CA7CA9
SCHEMBL13609971 0.83 CA12 (0.54) CA12CA1CA2CA7CA9
SCHEMBL14301487 0.82 ESR1 (0.55) CA12CA1CA2CA7CA9
SCHEMBL95477 0.82 CA1 (0.58) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1829854-B1 PROCESS FOR PRODUCING AROMATIC CARBONATE ASAHI KASEI CHEMICALS CORP (JP) 2013-09-04 EP disclosed
US-7629485-B2 Process for producing aromatic carbonate ASAHI KASEI CHEMICALS CORPORATION (JP) 2009-12-08 US disclosed
US-20080177099-A1 Process for Producing Aromatic Carbonate ASAHI KASEI KABUSHIKI KAISHA (JP) 2008-07-24 US disclosed
EP-1829854-A1 PROCESS FOR PRODUCING AROMATIC CARBONATE Asahi Kasei Chemicals Corporation (JP) 2007-09-05 EP disclosed
EP-1506249-B1 MULTIWALL POLYCARBONATE SHEET AND METHOD FOR ITS PRODUCTION GEN ELECTRIC (US) 2007-05-30 EP disclosed
CN-1111152-C method for producing aromatic carbonates ASAHI CHEMICAL IND (JP) 2003-06-11 CN disclosed
EP-1016648-B1 PROCESS FOR THE PREPARATION OF AROMATIC CARBONATES ASAHI CHEMICAL IND (JP) 2003-05-14 EP disclosed
US-6262210-B1 TRANSESTERIFYING DIALKYL CARBONATE, ALKYL ARYL CARBONATE OR MIXTURE WITH AROMATIC MONOHYDROXY COMPOUND IN PRESENCE OF METAL CONTAINING CATALYST TO OBTAIN HIGH BOILING POINT REACTION MIXTURE CONTAINING AROMATIC CARBONATE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2001-07-17 US disclosed
CN-1265641-A method for producing aromatic carbonates ASAHI CHEMICAL IND (JP) 2000-09-06 CN disclosed
EP-1016648-A1 PROCESS FOR THE PREPARATION OF AROMATIC CARBONATES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-07-05 EP disclosed
US-5550205-A MELT-POLYCONDENSING AROMATIC DIHYDROXY COMPOUNDS AND CARBONIC DIESTERS IN THE PRESENCE OF AN ALKALI METAL OR ALKALINE EARTH METAL CATALYST GENERAL ELECTRIC COMPANY (US) 1996-08-27 US 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-20080177099-A1 Process for Producing Aromatic Carbonate DCLK1, ALK, DCLK3 CA12 668/4885CA1 1665/4885CA2 449/4885

“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.