SCHEMBL7515173

SCHEMBL7515173

CC(C)n1nc(Cc2cccc(NC(=O)CCl)c2)c2c(N)ncnc21

nearest known ligand 0.76

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 16/20 0.76
▸ BTK Q06187 1/20 0.51
▸ ABL1 P00519 5/20 0.51
▸ HCK P08631 4/20 0.51
▸ PIK3CD O00329 3/20 0.48
▸ EGFR P00533 3/20 0.48
▸ KDR P35968 3/20 0.48
▸ PIK3CA P42336 3/20 0.48
▸ MTOR P42345 3/20 0.48
▸ PIK3CG P48736 3/20 0.48
▸ EPHB4 P54760 3/20 0.48
▸ PRKDC P78527 3/20 0.48
▸ PI4KB Q9UBF8 3/20 0.48
▸ PIK3CB P42338 2/20 0.48
▸ RET P07949 2/20 0.47
▸ BCR P11274 1/20 0.45
▸ BRAF P15056 1/20 0.45

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
SCHEMBL14982739 0.92 SRC (0.77) SRCABL1HCKPIK3CDEGFR
SCHEMBL12120704 0.86 SRC (0.75) SRCABL1HCKPIK3CDEGFR
SCHEMBL16572731 0.86 SRC (0.75) SRCABL1HCKPIK3CDEGFR
SCHEMBL7506714 0.86 SRC (1.00) SRCBTKABL1HCK
SCHEMBL12120464 0.84 SRC (0.71) SRCABL1HCKPIK3CDEGFR
SCHEMBL1320636 0.83 SRC (0.70) SRCABL1KDRRETBCR
SCHEMBL14974058 0.83 SRC (1.00) SRCABL1HCKPIK3CDEGFR
SCHEMBL12068730 0.82 SRC (1.00) SRCABL1HCKPIK3CDEGFR
SCHEMBL12123455 0.81 ABL1 (0.70) SRCBTKABL1HCKPIK3CD
SCHEMBL7515218 0.81 SRC (1.00) SRCABL1HCKPIK3CDEGFR

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 6 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
US-9353116-B2 Methods and compositions for kinase inhibition THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-05-31 — — US disclosed
US-20130137708-A1 METHODS AND COMPOSITIONS FOR KINASE INHIBITION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-05-30 — — US disclosed
WO-2011153553-A2 METHODS AND COMPOSITIONS FOR KINASE INHIBITION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-12-08 — — WO disclosed
WO-2011153553-A2 METHODS AND COMPOSITIONS FOR KINASE INHIBITION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-12-08 — — 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 (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-20130137708-A1 METHODS AND COMPOSITIONS FOR KINASE INHIBITION SRC, ABL1, LCK SRC 1/4885BTK 12/4885ABL1 2/4885

“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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