SCHEMBL10267352

SCHEMBL10267352

c1ccc(-c2oc3c(cc(-c4ccc(-c5cccc6ccccc56)cc4)c4c5oc(-c6ccccc6)c(-c6ccccc6)c5cc(-c5ccc(-c6ccc7ccccc7c6)cc5)c34)c2-c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
PIM1 P11309 2/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.38
ENPP3 O14638 1/20 0.36
ENPP1 P22413 1/20 0.36
ABCG2 Q9UNQ0 2/20 0.36
CYP1A1 P04798 1/20 0.36
CYP1B1 Q16678 1/20 0.36
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
PPARG P37231 3/20 0.34
PPARA Q07869 3/20 0.34
CYP2C19 P33261 2/20 0.34
GPR84 Q9NQS5 1/20 0.34
CYP2C9 P11712 1/20 0.34
PPARD Q03181 1/20 0.34

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
SCHEMBL10260776 0.97 CA12 (0.40) CA12CA1CA2CA9PIM1
SCHEMBL10260212 0.96 PIM1 (0.40) CA12CA1CA2CA9PIM1
SCHEMBL10259819 0.96 PIM1 (0.40) CA12CA1CA2CA9PIM1
SCHEMBL10260202 0.96 PIM1 (0.40) CA12CA1CA2CA9PIM1
SCHEMBL15334682 0.95 PIM1 (0.39) CA12CA1CA2CA9PIM1
SCHEMBL10259359 0.94 CA12 (0.42) CA12CA1CA2CA9ALDH1A1
SCHEMBL10259765 0.93 ENPP3 (0.41) CA12CA1CA2CA9ALDH1A1
SCHEMBL10259759 0.90 PIM1 (0.36) CA12CA1CA2CA9PIM1
SCHEMBL15334684 0.90 GPR84 (0.37) CA12CA1CA2CA9PIM1
SCHEMBL15334680 0.90 ABCG2 (0.39) CA12CA1CA2CA9PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8563972-B2 Electroactive materials E I DU PONT DE NEMOURS AND COMPANY (US) 2013-10-22 US disclosed
US-8563972-B2 Electroactive materials E I DU PONT DE NEMOURS AND COMPANY (US) 2013-10-22 US disclosed
US-20130248838-A1 ELECTROACTIVE MATERIALS E I DU PONT DE NEMOURS AND COMPANY (US) 2013-09-26 US disclosed
US-20130248838-A1 ELECTROACTIVE MATERIALS E I DU PONT DE NEMOURS AND COMPANY (US) 2013-09-26 US disclosed
US-8471251-B2 Electroactive materials E.I. DU PONT DE NEMOURS AND COMPANY (US) 2013-06-25 US disclosed
US-8471251-B2 Electroactive materials E.I. DU PONT DE NEMOURS AND COMPANY (US) 2013-06-25 US disclosed
US-20120319571-A1 ELECTROACTIVE MATERIALS E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-20 US disclosed
US-20120319571-A1 ELECTROACTIVE MATERIALS E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-20 US disclosed
US-8324619-B2 Electroactive materials E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-04 US disclosed
US-8324619-B2 Electroactive materials E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-04 US disclosed
US-20120228593-A1 ELECTROACTIVE MATERIALS E I DU PONT DE NEMOURS AND COMPANY (US) 2012-09-13 US disclosed
US-20120228593-A1 ELECTROACTIVE MATERIALS E I DU PONT DE NEMOURS AND COMPANY (US) 2012-09-13 US disclosed
US-8212239-B2 Electroactive materials E I DU PONT DE NEMOURS AND COMPANY (US) 2012-07-03 US disclosed
US-8212239-B2 Electroactive materials E I DU PONT DE NEMOURS AND COMPANY (US) 2012-07-03 US disclosed
US-20110042652-A1 ELECTROACTIVE MATERIALS E.I.DU PONT DE NEMOURS AND COMPANY 2011-02-24 US disclosed
US-20110042652-A1 ELECTROACTIVE MATERIALS E.I.DU PONT DE NEMOURS AND COMPANY 2011-02-24 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 (3 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-20120319571-A1 ELECTROACTIVE MATERIALS RCOR3, KCNN4, MSRB3 CA12 1607/4885CA1 1086/4885CA2 595/4885
US-20120228593-A1 ELECTROACTIVE MATERIALS RCOR3, KCNN4, MSRB3 CA12 1607/4885CA1 1086/4885CA2 595/4885
US-20110042652-A1 ELECTROACTIVE MATERIALS RCOR3, KCNN4, MSRB3 CA12 1607/4885CA1 1086/4885CA2 595/4885

“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.