SCHEMBL2015974

SCHEMBL2015974

COc1cc(N2CCN(C)CC2)ccc1Nc1ncc2scc(-c3cccc(N)c3)c2n1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.59
ALK Q9UM73 3/20 0.58
BRD4 O60885 2/20 0.56
JAK2 O60674 1/20 0.56
PTK2 Q05397 1/20 0.55
TNK2 Q07912 5/20 0.53
TTK P33981 4/20 0.53
INSR P06213 1/20 0.51
NPM1 P06748 1/20 0.51
GAK O14976 1/20 0.51
DCLK1 O15075 1/20 0.51
MAPK7 Q13164 1/20 0.51
TNK1 Q13470 1/20 0.51
LRRK2 Q5S007 1/20 0.51
DCLK2 Q8N568 1/20 0.51
IGF1R P08069 1/20 0.51

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
SCHEMBL12371236 0.89 JAK2 (0.58) BRD4JAK2PTK2MAPK7
SCHEMBL2015337 0.88 PTK2 (0.65) EGFRALKBRD4JAK2PTK2
SCHEMBL29847131 0.86 TTK (0.70) EGFRALKBRD4JAK2TNK2
SCHEMBL16514970 0.86 TTK (0.70) EGFRALKBRD4JAK2TNK2
SCHEMBL2267020 0.84 JAK3 (0.65) EGFRALKJAK2PTK2TTK
SCHEMBL16514286 0.77 TTK (0.85) EGFRALKTNK2TTKINSR
SCHEMBL29847405 0.77 TTK (0.85) EGFRALKTNK2TTKINSR
SCHEMBL12371233 0.77 PTK2 (0.67) EGFRBRD4JAK2PTK2MAPK7
SCHEMBL1674187 0.77 PTK2 (0.74) BRD4JAK2PTK2
SCHEMBL29523722 0.77 PTK2 (0.74) BRD4JAK2PTK2

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 7 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-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-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
US-20110207736-A1 COMPOUNDS THAT MODULATE EGFR ACTIVITY AND METHODS FOR TREATING OR PREVENTING CONDITIONS THEREWITH Gatekeeper Pharmaceuticals, Inc. 2011-08-25 US disclosed
WO-2011079231-A1 COMPOUNDS THAT MODULATE EGFR ACTIVITY AND METHODS FOR TREATING OR PREVENTING CONDITIONS THEREWITH GATEKEEPER PHARMACEUTICAL, INC. (US) 2011-06-30 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 (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 EGFR 1/4885ALK 911/4885BRD4 1365/4885
US-20140011810-A1 Compounds that Modulate EGFR Activity and Methods for Treating or Preventing Conditions Therewith EGFR, ERBB2, BRCA1 EGFR 1/4885ALK 911/4885BRD4 1365/4885

“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.