SCHEMBL718295

SCHEMBL718295

Oc1cccc(C#Cc2cccc(O)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.60
CA2 P00918 4/20 0.60
CA9 Q16790 4/20 0.60
CA1 P00915 3/20 0.60
ALDH1A1 P00352 2/20 0.58
CYP3A4 P08684 2/20 0.58
CA14 Q9ULX7 2/20 0.58
LMNA P02545 1/20 0.58
CA5A P35218 1/20 0.58
HSD17B10 Q99714 1/20 0.58
CA5B Q9Y2D0 1/20 0.58
FFAR1 O14842 2/20 0.55
GRM5 P41594 2/20 0.55
HSD17B1 P14061 2/20 0.46
HSD17B2 P37059 2/20 0.46
ACHE P22303 2/20 0.46
TSHR P16473 1/20 0.46
CYP2C9 P11712 1/20 0.46
CA7 P43166 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL722068 0.93 CA12 (0.59) CA12CA2CA9CA1ALDH1A1
SCHEMBL30493627 0.93 CA12 (0.59) CA12CA2CA9CA1ALDH1A1
SCHEMBL12289090 0.91 CA12 (0.62) CA12CA2CA9CA1ALDH1A1
SCHEMBL18130072 0.87 CA12 (0.59) CA12CA2CA9CA1ALDH1A1
SCHEMBL27941360 0.87 CA12 (0.50) CA12CA2CA9CA1FFAR1
SCHEMBL4528675 0.87 CA12 (0.50) CA12CA2CA9CA1ALDH1A1
SCHEMBL7054237 0.87 CA12 (0.54) CA12CA2CA9CA1ALDH1A1
SCHEMBL29640419 0.87 CA12 (0.59) CA12CA2CA9CA1ALDH1A1
SCHEMBL2814308 0.85 CA12 (0.49) CA12CA2CA9CA1ALDH1A1
SCHEMBL20489172 0.85 CA12 (0.49) CA12CA2CA9CA1ALDH1A1

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 97 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8519080-B2 Crosslinkable prepolymer, its production process and its uses ASAHI GLASS COMPANY, LIMITED (JP) 2013-08-27 US claimed
EP-2561004-A1 POLYCARBONATE COPOLYMER Styron Europe GmbH (CH) 2013-02-27 EP claimed
US-8168742-B2 Crosslinkable fluorinated aromatic prepolymer and its uses ASAHI GLASS COMPANY, LIMITED (JP) 2012-05-01 US claimed
WO-2011131366-A1 POLYCARBONATE COPOLYMER STYRON EUROPE GMBH (CH) 2011-10-27 WO claimed
US-6156812-A Nanoporous material fabricated using polymeric template strands HONEYWELL INTERNATIONAL INC. (US) 2000-12-05 US claimed
US-9575246-B2 Prepolymer, curable material, coating composition, non-linear optical material, optical waveguide and light control device ASAHI GLASS COMPANY, LIMITED (JP) 2017-02-21 US disclosed
EP-2792665-B1 LIQUID REPELLENT COMPOSITION, LIQUID REPELLENT POLYMER, CURABLE COMPOSITION, COATING COMPOSITION, ARTICLE HAVING CURED FILM, ARTICLE HAVING PATTERN OF LIQUID-PHILIC REGION AND LIQUID REPELLENT REGION, AND PROCESS FOR PRODUCING IT ASAHI GLASS CO LTD (JP) 2016-08-03 EP disclosed
EP-2266792-B1 ELECTRET AND ELECTROSTATIC INDUCTION CONVERSION DEVICE ASAHI GLASS CO LTD (JP) 2016-05-04 EP disclosed
US-20150273457-A1 HIGHLY ACTIVE MULTIDENTATE CATALYSTS FOR EFFICIENT ALKYNE METATHESIS NATIONAL SCIENCE FOUNDATION 2015-10-01 US disclosed
US-20150273457-A1 HIGHLY ACTIVE MULTIDENTATE CATALYSTS FOR EFFICIENT ALKYNE METATHESIS NATIONAL SCIENCE FOUNDATION 2015-10-01 US disclosed
EP-2889684-A1 PREPOLYMER, CURABLE MATERIAL, COATING COMPOSITION, NON-LINEAR OPTICAL MATERIAL, OPTICAL WAVEGUIDE AND LIGHT CONTROL DEVICE Asahi Glass Company, Limited (JP) 2015-07-01 EP disclosed
US-20150153509-A1 PREPOLYMER, CURABLE MATERIAL, COATING COMPOSITION, NON-LINEAR OPTICAL MATERIAL, OPTICAL WAVEGUIDE AND LIGHT CONTROL DEVICE ASAHI GLASS COMPANY, LIMITED (JP) 2015-06-04 US disclosed
US-6214746-B1 DIELECTRIC NANOPOROUS MATERIAL HONEYWELL INTERNATIONAL INC. 2001-04-10 US disclosed
US-6171687-B1 LOW DIELECTRIC CONSTANT POROUS STRUCTURAL LAYER COMPRISING A SUBSTRATE LAYER, A POLYMERIC LOW DIELECTRIC STRUCTURAL LAYER, AND LAYER OF A VOLATILE INFILTRATING MATERIAL AND REINFORCING COMPONENT COATING SOME OF THE VOIDS; INCREASED STRENGTH HONEYWELL INTERNATIONAL INC. 2001-01-09 US disclosed
US-6172128-B1 FABRICATING NANOPOROUS MATERIAL BY CROSSLINKING TWO POLYMERIC STRANDS, EACH HAVING A CROSSLINKING FUNCTIONALITY AND AT LEAST ONE HAVING A THERMOLABILE PORTION, TO FORM A CYCLIC STRUCTURE FOLLOWED BY THERMOLYSIS OF THERMOLABILE PORTION HONEYWELL INTERNATIONAL INC. 2001-01-09 US disclosed
US-6156812-A Nanoporous material fabricated using polymeric template strands HONEYWELL INTERNATIONAL INC. (US) 2000-12-05 US disclosed
US-6156812-A Nanoporous material fabricated using polymeric template strands HONEYWELL INTERNATIONAL INC. (US) 2000-12-05 US disclosed
WO-2000068956-A1 NANOPOROUS MATERIAL FABRICATED USING A DISSOLVABLE REAGENT ALLIEDSIGNAL INC. (US) 2000-11-16 WO disclosed
WO-2000061667-A1 POLYMERS HAVING BACKBONES WITH REACTIVE GROUPS EMPLOYED IN CROSSLINKING AS PRECURSORS TO NANOPOROUS THIN FILM STRUCTURES ALLIEDSIGNAL INC. (US) 2000-10-19 WO disclosed
WO-2000007975-A1 LIQUID CRYSTALLINE COMPOUNDS ROLIC AG (CH) 2000-02-17 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-20150273457-A1 HIGHLY ACTIVE MULTIDENTATE CATALYSTS FOR EFFICIENT ALKYNE METATHESIS PCNA, TRIM58, CAD CA12 497/4885CA2 1100/4885CA9 1042/4885

“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.