SCHEMBL2276324

SCHEMBL2276324

CCOCCn1cnc(-c2cccc(Cc3nn(-c4cnn(C)c4)ccc3=O)c2)n1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
IGF1R P08069 6/20 0.32
ENPP2 Q13822 1/20 0.31
FYN P06241 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL13275090 0.92 IGF1R (0.39) PPARGPPARAIGF1RENPP2FYN
SCHEMBL13275084 0.91 IGF1R (0.35) IGF1RENPP2FYNHDAC1HDAC6
SCHEMBL2262984 0.90 IGF1R (0.36) IGF1RENPP2FYNHDAC1HDAC6
SCHEMBL2262464 0.89 DGAT1 (0.36) IGF1RENPP2FYNHDAC1HDAC6
SCHEMBL13274689 0.89 IGF1R (0.40) PPARGPPARAIGF1RENPP2FYN
SCHEMBL12517718 0.88 IRAK4 (0.36) IGF1RENPP2FYN
SCHEMBL13274751 0.87 DGAT1 (0.37) PPARGPPARAENPP2FYNHDAC1
SCHEMBL2363296 0.87 KAT6A (0.33) PPARGPPARAIGF1RHDAC1HDAC6
SCHEMBL2268875 0.87 FYN (0.33) IGF1RENPP2FYNHDAC1HDAC6
SCHEMBL13274739 0.86 PPARG (0.32) PPARGPPARAIGF1RENPP2

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
EP-2515657-A1 TYROSINE KINASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-10-31 EP claimed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US claimed
WO-2011084402-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-07-14 WO claimed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US disclosed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US disclosed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US disclosed
WO-2011084402-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-07-14 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-20120264735-A1 TYROSINE KINASE INHIBITORS ABL1, MET, ERBB2 PPARG 2354/4885PPARA 3069/4885IGF1R 152/4885

“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.