SCHEMBL1318894

SCHEMBL1318894

Cn1nc(Cc2cccc(N)c2)c2c(N)ncnc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 13/20 0.62
▸ AKT1 P31749 1/20 0.57
▸ PIK3CD O00329 4/20 0.49
▸ PIK3CA P42336 4/20 0.49
▸ PIK3CB P42338 4/20 0.49
▸ PIK3CG P48736 4/20 0.49
▸ PRKDC P78527 4/20 0.49
▸ ABL1 P00519 4/20 0.45
▸ HCK P08631 2/20 0.45
▸ EGFR P00533 1/20 0.45
▸ KDR P35968 1/20 0.45
▸ MTOR P42345 1/20 0.45
▸ EPHB4 P54760 1/20 0.45
▸ BTK Q06187 1/20 0.44
▸ RET P07949 1/20 0.44
▸ RIPK2 O43353 1/20 0.43
▸ PRKD3 O94806 1/20 0.43
▸ FYN P06241 1/20 0.43
▸ PRKACA P17612 1/20 0.43
▸ CDK2 P24941 1/20 0.43

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
SCHEMBL1320349 0.84 SRC (0.73) SRCAKT1PIK3CDPIK3CAPIK3CB
SCHEMBL1318810 0.84 SRC (0.79) SRCAKT1PIK3CDPIK3CAPIK3CB
SCHEMBL1317955 0.83 SRC (0.58) SRCAKT1PIK3CDPIK3CAPIK3CB
SCHEMBL1318725 0.81 BTK (0.60) SRCAKT1PIK3CDPIK3CAPIK3CB
SCHEMBL1318686 0.79 SRC (0.66) SRCAKT1PIK3CDPIK3CAPIK3CB
SCHEMBL12120698 0.78 AURKA (0.67) SRCABL1EGFRKDRBTK
SCHEMBL7507622 0.78 SRC (1.00) SRCAKT1PIK3CDPIK3CAPIK3CG
SCHEMBL12120452 0.76 SRC (0.60) SRCABL1KDR
SCHEMBL12551798 0.75 SRC (0.52) SRCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL29387839 0.75 SRC (0.73) SRCPIK3CDPIK3CAPIK3CBPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9353116-B2 Methods and compositions for kinase inhibition THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-05-31 — — US disclosed
US-9353116-B2 Methods and compositions for kinase inhibition THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-05-31 — — US disclosed
EP-2358720-B1 FUSED RING HETEROARYL KINASE INHIBITORS UNIV CALIFORNIA (US) 2016-03-02 — — EP disclosed
US-8697709-B2 Fused ring heteroaryl kinase inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-04-15 — — US disclosed
US-20110275651-A1 FUSED RING HETEROARYL KINASE INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-11-10 — — 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 (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-20110275651-A1 FUSED RING HETEROARYL KINASE INHIBITORS CNKSR1, MAP3K20, TTK SRC 180/4885AKT1 57/4885PIK3CD 276/4885

“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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