SCHEMBL10259359

SCHEMBL10259359

c1ccc(-c2ccc(-c3ccc(-c4cc5c(-c6ccccc6)c(-c6ccccc6)oc5c5c(-c6ccc(-c7cccc8ccccc78)cc6)cc6c(-c7ccccc7)c(-c7ccccc7)oc6c45)cc3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA9 Q16790 3/20 0.42
ENPP3 O14638 1/20 0.40
ENPP1 P22413 1/20 0.40
CYP2C19 P33261 3/20 0.38
ALDH1A1 P00352 3/20 0.38
HSD17B10 Q99714 3/20 0.38
CYP1A2 P05177 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ATM Q13315 2/20 0.38
RAB9A P51151 1/20 0.38
MCL1 Q07820 1/20 0.37
ACMSD Q8TDX5 1/20 0.37
CYP2C9 P11712 2/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL10259765 0.99 ENPP3 (0.41) CA12CA1CA2CA9ENPP3
SCHEMBL10267352 0.94 CA12 (0.41) CA12CA1CA2CA9ENPP3
SCHEMBL10259819 0.93 PIM1 (0.40) CA12CA1CA2CA9ENPP3
SCHEMBL10260202 0.93 PIM1 (0.40) CA12CA1CA2CA9ENPP3
SCHEMBL10260212 0.93 PIM1 (0.40) CA12CA1CA2CA9ENPP3
SCHEMBL15334682 0.92 PIM1 (0.39) CA12CA1CA2CA9ENPP3
SCHEMBL10260776 0.91 CA12 (0.40) CA12CA1CA2CA9ENPP3
SCHEMBL10259759 0.87 PIM1 (0.36) CA12CA1CA2CA9ENPP3
SCHEMBL15334680 0.86 ABCG2 (0.39) CA12CA1CA2CA9ENPP3
SCHEMBL10259962 0.85 PIM1 (0.40) CYP2C19ALDH1A1HSD17B10CYP1A2KDM4E

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.