SCHEMBL12371236

SCHEMBL12371236

Cc1cc(N2CCN(C)CC2)ccc1Nc1ncc2scc(-c3cccc(N)c3)c2n1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.58
BRD4 O60885 2/20 0.58
PTK2 Q05397 17/20 0.51
LCK P06239 1/20 0.50
FYN P06241 1/20 0.50
FES P07332 1/20 0.50
RET P07949 1/20 0.50
ROS1 P08922 1/20 0.50
CDK4 P11802 1/20 0.50
SRC P12931 1/20 0.50
JAK1 P23458 1/20 0.50
TYK2 P29597 1/20 0.50
JAK3 P52333 1/20 0.50
EPHB1 P54762 1/20 0.50
CSNK2A1 P68400 1/20 0.50
DDR1 Q08345 1/20 0.50
KCNH2 Q12809 1/20 0.50
MAPK7 Q13164 1/20 0.49

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
SCHEMBL2015974 0.89 EGFR (0.59) JAK2BRD4PTK2MAPK7
SCHEMBL12371233 0.87 PTK2 (0.67) JAK2BRD4PTK2LCKFYN
SCHEMBL12371121 0.84 FGFR1 (0.67) JAK2BRD4PTK2JAK1JAK3
SCHEMBL29523722 0.79 PTK2 (0.74) JAK2BRD4PTK2LCKFYN
SCHEMBL1674187 0.79 PTK2 (0.74) JAK2BRD4PTK2LCKFYN
SCHEMBL2015337 0.77 PTK2 (0.65) JAK2BRD4PTK2MAPK7
SCHEMBL29847131 0.75 TTK (0.70) JAK2BRD4MAPK7
SCHEMBL16514970 0.75 TTK (0.70) JAK2BRD4MAPK7
SCHEMBL2267020 0.74 JAK3 (0.65) JAK2PTK2JAK1JAK3
SCHEMBL16514362 0.73 JAK2 (0.70) JAK2BRD4CDK4JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9879028-B2 Compounds that modulate EGFR activity and methods for treating or preventing conditions therewith Gatekeeper Pharmaceuticals, Inc. (US) 2018-01-30 US disclosed
US-20140011810-A1 Compounds that Modulate EGFR Activity and Methods for Treating or Preventing Conditions Therewith Gatekeeper Pharmaceuticals, Inc. (US) 2014-01-09 US disclosed
US-20110207736-A1 COMPOUNDS THAT MODULATE EGFR ACTIVITY AND METHODS FOR TREATING OR PREVENTING CONDITIONS THEREWITH Gatekeeper Pharmaceuticals, Inc. 2011-08-25 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-20110207736-A1 COMPOUNDS THAT MODULATE EGFR ACTIVITY AND METHODS FOR TREATING OR PREVENTING CONDITIONS THEREWITH EGFR, ERBB2, BRCA1 JAK2 53/4885BRD4 1365/4885PTK2 29/4885
US-20140011810-A1 Compounds that Modulate EGFR Activity and Methods for Treating or Preventing Conditions Therewith EGFR, ERBB2, BRCA1 JAK2 53/4885BRD4 1365/4885PTK2 29/4885

“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.