SCHEMBL2984644

SCHEMBL2984644

COCOc1ccc2ccc(=O)oc2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 11/20 0.71
CA9 Q16790 11/20 0.71
CA1 P00915 9/20 0.71
CA6 P23280 5/20 0.71
CA7 P43166 5/20 0.71
CA14 Q9ULX7 5/20 0.71
CA4 P22748 5/20 0.71
CA5A P35218 3/20 0.71
CA5B Q9Y2D0 3/20 0.71
CYP1A2 P05177 1/20 0.71
KDM4E B2RXH2 5/20 0.68
ALDH1A1 P00352 4/20 0.68
CA3 P07451 3/20 0.68
CA2 P00918 3/20 0.68
HPGD P15428 2/20 0.68
HSD17B10 Q99714 2/20 0.68
AKR1B1 P15121 1/20 0.68
NPC1 O15118 3/20 0.65
RAB9A P51151 2/20 0.65
MTNR1A P48039 3/20 0.61

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
SCHEMBL3584796 0.89 CYP2A6 (0.69) CA12CA9CA1CA6CA7
SCHEMBL19194269 0.84 CA12 (0.77) CA12CA9CA1CA6CA7
Ethoxycoumarin SCHEMBL119072 0.83 CA9 (1.00) CA12CA9CA1CA6CA7
SCHEMBL19886586 0.83 CA9 (0.68) CA12CA9CA1CA6CA7
SCHEMBL12304245 0.83 CA12 (0.81) CA12CA9CA1CA6CA7
SCHEMBL19147577 0.82 MCL1 (0.67) CA12CA9CA1CA6CA7
Herniarin SCHEMBL61221 0.81 CA12 (1.00) CA12CA9CA1CA6CA7
Herniarin SCHEMBL17629468 0.81 CA12 (1.00) CA12CA9CA1CA6CA7
Herniarin SCHEMBL29437733 0.81 CA12 (1.00) CA12CA9CA1CA6CA7
7-Butoxycoumarin SCHEMBL6686295 0.81 CA12 (1.00) CA12CA9CA1CA6CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9620363-B2 Underlayer film-forming composition and pattern forming process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-04-11 US disclosed
US-20140363956-A1 UNDERLAYER FILM-FORMING COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-12-11 US disclosed
US-7786161-B2 Carboxylic acid derivatives and pharmaceutical agent comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2010-08-31 US disclosed
US-7786161-B2 Carboxylic acid derivatives and pharmaceutical agent comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2010-08-31 US disclosed
US-7786161-B2 Carboxylic acid derivatives and pharmaceutical agent comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2010-08-31 US disclosed
US-20090318703-A1 CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL AGENT COMPRISING THE SAME AS ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD (JP) 2009-12-24 US disclosed
US-20090318703-A1 CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL AGENT COMPRISING THE SAME AS ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD (JP) 2009-12-24 US disclosed
US-20090318703-A1 CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL AGENT COMPRISING THE SAME AS ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD (JP) 2009-12-24 US disclosed
US-20090286862-A1 Therapeutic agent for psychoneurotic disease ONO PHARMACEUTICAL CO., LTD. (JP) 2009-11-19 US disclosed
US-7576129-B2 Carboxylic acid compounds ONO PHARMACEUTICAL CO., LTD. (JP) 2009-08-18 US disclosed
US-7491748-B2 Carboxylic acid derivative compounds and drugs comprising these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2009-02-17 US disclosed
US-7491748-B2 Carboxylic acid derivative compounds and drugs comprising these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2009-02-17 US disclosed
US-7491748-B2 Carboxylic acid derivative compounds and drugs comprising these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2009-02-17 US disclosed
US-20070167498-A1 Carboxylic acid compounds ONO PHARMACEUTICAL CO., LTD. (JP) 2007-07-19 US disclosed
EP-1787657-A1 THERAPEUTIC AGENT FOR PSYCHONEUROTIC DISEASE ONO PHARMACEUTICAL CO., LTD. (JP) 2007-05-23 EP disclosed
US-20060258728-A1 Carboxylic acid derivative compounds and drugs comprising these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2006-11-16 US disclosed
EP-1591441-A1 CARBOXYLIC ACID COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2005-11-02 EP disclosed
EP-1431267-A1 CARBOXYLIC ACID DERIVATIVE COMPOUNDS AND DRUGS COMPRISING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-06-23 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 (4 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-20090318703-A1 CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL AGENT COMPRISING THE SAME AS ACTIVE INGREDIENT PTGER2, PTGER4, PTGER1 CA12 450/4885CA9 1181/4885CA1 260/4885
US-20090286862-A1 Therapeutic agent for psychoneurotic disease PTGER3, PTGER1, PTGES3 CA12 3739/4885CA9 4427/4885CA1 4238/4885
US-20060258728-A1 Carboxylic acid derivative compounds and drugs comprising these compounds as the active ingredient PTGER2, PTGER4, PTGER1 CA12 488/4885CA9 1069/4885CA1 273/4885
US-20070167498-A1 Carboxylic acid compounds PTGER3, CNR2, PTGER2 CA12 1850/4885CA9 2557/4885CA1 2028/4885

“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.