SCHEMBL2592987

SCHEMBL2592987

CNC(=O)c1ccccc1Nc1nc(Cl)nc2c1c(C)nn2C1CCCCO1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 1/20 0.42
PTK2 Q05397 9/20 0.41
INSR P06213 2/20 0.41
IGF1R P08069 2/20 0.41
PTK2B Q14289 2/20 0.41
PKMYT1 Q99640 1/20 0.41
CDK7 P50613 2/20 0.41
CDK9 P50750 1/20 0.41
SLC2A1 P11166 1/20 0.41
ULK1 O75385 2/20 0.40
MAPK1 P28482 2/20 0.40
MAPK3 P27361 1/20 0.40
ACVR1 Q04771 1/20 0.39
EGFR P00533 4/20 0.39
MAPK8 P45983 2/20 0.39
MAPK9 P45984 2/20 0.39
MAPK10 P53779 2/20 0.39
CDC7 O00311 1/20 0.39
PLK4 O00444 1/20 0.39
CHEK1 O14757 1/20 0.39

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
SCHEMBL12179307 1.00 YTHDC1 (0.42) YTHDC1PTK2INSRIGF1RPTK2B
SCHEMBL17746923 0.83 PTK2 (0.43) PTK2INSRIGF1RPTK2BPKMYT1
SCHEMBL2595099 0.81 PTK2 (0.46) PTK2INSRIGF1RPTK2BPKMYT1
SCHEMBL17746922 0.79 PTK2 (0.36) PTK2INSRIGF1RPTK2BPKMYT1
SCHEMBL2589013 0.79 PTK2 (0.44) PTK2INSRIGF1RPTK2BPKMYT1
SCHEMBL29114626 0.76 YTHDC1 (0.45) YTHDC1ACVR1RET
SCHEMBL29738752 0.74 GAA (0.45) YTHDC1ACVR1RET
SCHEMBL2595000 0.74 GAA (0.45) YTHDC1ACVR1RET
SCHEMBL29738772 0.73 YTHDC1 (0.42) YTHDC1ACVR1CDK1SYK
SCHEMBL29738737 0.72 YTHDC1 (0.41) YTHDC1MAPK1ACVR1

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-20160137610-A1 Compounds that Modulate EGFR Activity and Methods for Treating or Preventing Conditions Therewith Gatekeeper Pharmaceuticals, Inc. 2016-05-19 US disclosed
US-20160137610-A1 Compounds that Modulate EGFR Activity and Methods for Treating or Preventing Conditions Therewith Gatekeeper Pharmaceuticals, Inc. 2016-05-19 US disclosed
US-20160137610-A1 Compounds that Modulate EGFR Activity and Methods for Treating or Preventing Conditions Therewith Gatekeeper Pharmaceuticals, Inc. 2016-05-19 US disclosed
US-20130137709-A1 Compounds that modulate EGFR activity and methods for treating or preventing conditions therewith Gatekeeper Pharmaceuticals, Inc. 2013-05-30 US disclosed
US-20130137709-A1 Compounds that modulate EGFR activity and methods for treating or preventing conditions therewith Gatekeeper Pharmaceuticals, Inc. 2013-05-30 US disclosed
US-20130137709-A1 Compounds that modulate EGFR activity and methods for treating or preventing conditions therewith Gatekeeper Pharmaceuticals, Inc. 2013-05-30 US disclosed
WO-2011140338-A1 COMPOUNDS THAT MODULATE EGFR ACTIVITY AND METHODS FOR TREATING OR PREVENTING CONDITIONS THEREWITH Gatekeeper Pharmaceuticals, Inc. (US) 2011-11-10 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-20160137610-A1 Compounds that Modulate EGFR Activity and Methods for Treating or Preventing Conditions Therewith EGFR, ERBB2, BRCA1 YTHDC1 4760/4885PTK2 29/4885INSR 428/4885
US-20130137709-A1 Compounds that modulate EGFR activity and methods for treating or preventing conditions therewith EGFR, ERBB2, BRCA1 YTHDC1 4760/4885PTK2 29/4885INSR 428/4885

“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.