SCHEMBL13609505

SCHEMBL13609505

COc1ccc(Br)c(-c2cc(C)c3nc(N)nnc3c2)c1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 11/20 0.53
▸ NPC1 O15118 2/20 0.39
▸ DHFR P00374 3/20 0.39
▸ PDK1 Q15118 1/20 0.36
▸ NQO2 P16083 1/20 0.35
▸ HSP90AA1 P07900 1/20 0.34
▸ HSP90AB1 P08238 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ ADORA1 P30542 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
SCHEMBL4273050 0.89 SRC (0.57) SRCNPC1DHFRHSP90AA1HSP90AB1
SCHEMBL4264699 0.85 SRC (0.70) SRCHSP90AA1HSP90AB1
SCHEMBL15095302 0.85 SRC (0.58) SRCADORA2AADORA1
SCHEMBL13609478 0.77 SRC (0.69) SRCADORA2AADORA1
SCHEMBL4270715 0.73 SRC (0.57) SRCHSP90AA1HSP90AB1
SCHEMBL13609499 0.72 SRC (0.59) SRCNPC1DHFRHSP90AA1HSP90AB1
SCHEMBL4270512 0.72 SRC (0.59) SRCDHFRHSP90AA1
SCHEMBL4275174 0.70 SRC (1.00) SRC
SCHEMBL4266529 0.70 SRC (0.79) SRCHSP90AA1HSP90AB1
SCHEMBL4264301 0.70 SRC (0.66) SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1809614-B1 BENZOTRIAZINE INHIBITORS OF KINASES TARGEGEN INC (US) 2014-05-07 — — EP disclosed
US-8481536-B2 Benzotriazine inhibitors of kinases TARGEGEN, INC. (US) 2013-07-09 — — US disclosed
EP-2543376-A1 Benzotriazine inhibitors of kinases Targegen, Inc. (US) 2013-01-09 — — EP disclosed
US-20110294796-A1 BENZOTRIAZINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-12-01 — — US disclosed
US-20090275569-A1 Benzotriazine Inhibitors of Kinases TARGEGEN, INC. 2009-11-05 — — US disclosed
US-20090275569-A1 Benzotriazine Inhibitors of Kinases TARGEGEN, INC. 2009-11-05 — — US disclosed
US-7456176-B2 Benzotriazine inhibitors of kinases TARGEGEN, INC. (US) 2008-11-25 — — US disclosed
US-7456176-B2 Benzotriazine inhibitors of kinases TARGEGEN, INC. (US) 2008-11-25 — — 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 (2 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-20110294796-A1 BENZOTRIAZINE INHIBITORS OF KINASES SRC, CAMK4, CAMK2G SRC 1/4885NPC1 3968/4885DHFR 1676/4885
US-20090275569-A1 Benzotriazine Inhibitors of Kinases SRC, CAMK4, CAMK2G SRC 1/4885NPC1 3968/4885DHFR 1676/4885

“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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