SCHEMBL12336254

SCHEMBL12336254

COc1ccc2c(Oc3ccc(-c4cnc(Nc5cccc(C(F)(F)F)c5)[nH]4)cc3)ccnc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3A P49840 1/20 0.50
▸ GSK3B P49841 1/20 0.50
▸ KDR P35968 7/20 0.48
▸ BRAF P15056 4/20 0.48
▸ MAPK14 Q16539 2/20 0.48
▸ TNNI3K Q59H18 2/20 0.48
▸ GAK O14976 1/20 0.46
▸ FGFR2 P21802 4/20 0.42
▸ ABCG2 Q9UNQ0 2/20 0.42
▸ EGFR P00533 2/20 0.42
▸ CLK2 P49760 1/20 0.41
▸ IRAK1 P51617 1/20 0.41
▸ NEK4 P51957 1/20 0.41
▸ MAP4K2 Q12851 1/20 0.41
▸ HIPK4 Q8NE63 1/20 0.41
▸ SRPK1 Q96SB4 1/20 0.41
▸ CLK4 Q9HAZ1 1/20 0.41
▸ MKNK2 Q9HBH9 1/20 0.41
▸ MAP3K20 Q9NYL2 1/20 0.41
▸ STK17A Q9UEE5 1/20 0.41

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
SCHEMBL14949238 0.88 KDR (0.49) KDRFGFR2PDGFRAMET
SCHEMBL12336406 0.86 GSK3A (0.50) GSK3AGSK3BKDRBRAFMAPK14
SCHEMBL12336249 0.82 GSK3A (0.49) GSK3AGSK3BKDRBRAFMAPK14
SCHEMBL17661802 0.81 MET (0.42) GSK3AGSK3BKDRBRAFMAPK14
SCHEMBL12336497 0.80 GSK3A (0.51) GSK3AGSK3BKDRBRAFMAPK14
SCHEMBL12336455 0.80 GSK3A (0.47) GSK3AGSK3BKDRBRAFMAPK14
SCHEMBL12336407 0.80 GSK3B (0.53) GSK3AGSK3BKDRBRAFMAPK14
SCHEMBL14952388 0.80 FGFR2 (0.46) GSK3AGSK3BKDRBRAFMAPK14
SCHEMBL12336414 0.80 GAK (0.50) GSK3AGSK3BKDRBRAFMAPK14
SCHEMBL12336222 0.79 BRAF (0.51) GSK3AGSK3BKDRBRAFMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2550266-B1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION AMITECH THERAPEUTICS SOLUTIONS INC (US) 2018-05-09 — — EP disclosed
US-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2016-04-07 — — US disclosed
US-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2016-04-07 — — US disclosed
US-9212151-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-12-15 — — US disclosed
US-9212151-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-12-15 — — US disclosed
US-20150158828-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2015-06-11 — — US disclosed
US-20150158828-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2015-06-11 — — US disclosed
US-8957216-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-02-17 — — US disclosed
US-8957216-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-02-17 — — US disclosed
US-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION AMITECH THERAPEUTIC SOLUTIONS INC (US) 2013-05-16 — — US disclosed
US-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION AMITECH THERAPEUTIC SOLUTIONS INC (US) 2013-05-16 — — US disclosed
WO-2011119894-A2 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION KINAGEN, INC (US) 2011-09-29 — — 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 (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-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION MAP4K2, MAP3K20, MAP3K19 GSK3A 590/4885GSK3B 581/4885KDR 533/4885
US-20150158828-A1 Heterocyclic Compounds Useful for Kinase Inhibition MAP4K2, MAP3K20, MAP3K19 GSK3A 590/4885GSK3B 581/4885KDR 533/4885
US-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition MAP4K2, MAP3K20, MAP3K19 GSK3A 590/4885GSK3B 581/4885KDR 533/4885

“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.

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