SCHEMBL5446183

SCHEMBL5446183

O=S(=O)(c1ccc(Nc2ncc(/C=C/c3cccc4[nH]ccc34)cn2)cc1)N1CCNCC1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 11/20 0.44
CHUK O15111 11/20 0.44
PRKCQ Q04759 7/20 0.43
PRKCD Q05655 7/20 0.43
SRC P12931 1/20 0.42
CA12 O43570 1/20 0.41
ABL1 P00519 1/20 0.41
CA2 P00918 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
SCHEMBL5446188 1.00 IKBKB (0.44) IKBKBCHUKPRKCQPRKCDSRC
SCHEMBL5445596 0.97 CA12 (0.44) IKBKBCHUKPRKCQPRKCDSRC
SCHEMBL5445592 0.97 CA12 (0.44) IKBKBCHUKPRKCQPRKCDSRC
SCHEMBL5442265 0.91 PRKCQ (0.45) IKBKBCHUKPRKCQPRKCDSRC
SCHEMBL5442262 0.91 PRKCQ (0.45) IKBKBCHUKPRKCQPRKCDSRC
SCHEMBL5442125 0.89 PRKCQ (0.42) IKBKBCHUKPRKCQPRKCDSRC
SCHEMBL5442129 0.89 PRKCQ (0.42) IKBKBCHUKPRKCQPRKCDSRC
SCHEMBL5442216 0.88 IKBKB (0.44) IKBKBCHUKSRCCA12ABL1
SCHEMBL5442212 0.88 IKBKB (0.44) IKBKBCHUKSRCCA12ABL1
SCHEMBL14538059 0.87 PRKCQ (0.42) IKBKBCHUKPRKCQPRKCDSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations TARGEGEN, INC. (US) 2007-06-28 US disclosed
US-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations TARGEGEN, INC. (US) 2007-06-28 US disclosed
US-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations TARGEGEN, INC. (US) 2007-06-28 US disclosed
WO-2007056075-A2 SIX MEMBERED HETEROAROMATIC INHIBITORS TARGETING RESISTANT KINASE MUTATIONS TARGEGEN, INC. (US) 2007-05-18 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-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations ABL1, KDR, BCR IKBKB 204/4885CHUK 32/4885PRKCQ 434/4885

“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.