SCHEMBL370955

SCHEMBL370955

CCn1cc(-n2ccc(=O)c(COc3ccc4ncc(-c5ccccc5)cc4c3)n2)cn1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MET P08581 9/20 0.38
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
PDGFRB P09619 2/20 0.35
PDGFRA P16234 2/20 0.35
LRRK2 Q5S007 1/20 0.34
PPARG P37231 2/20 0.33
PPARA Q07869 2/20 0.33
EGLN1 Q9GZT9 2/20 0.33
GRIN2B Q13224 1/20 0.33
GRM4 Q14833 1/20 0.33

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
SCHEMBL368322 0.92 PDGFRB (0.41) METPDGFRBPDGFRALRRK2
SCHEMBL371343 0.92 PDGFRB (0.45) METPDGFRBPDGFRALRRK2
SCHEMBL14915761 0.92 MET (0.41) METALDH1A1PDGFRBPDGFRAGRIN2B
SCHEMBL10283523 0.91 MET (0.39) METPDGFRBPDGFRALRRK2GRIN2B
SCHEMBL10283772 0.91 MET (0.35) METKDM4EALDH1A1LMNAMAPT
SCHEMBL359863 0.90 PDGFRB (0.34) METKDM4EALDH1A1LMNAMAPT
SCHEMBL14916383 0.90 MET (0.42) METKDM4EALDH1A1LMNAMAPT
SCHEMBL14915783 0.89 JAK2 (0.38) PDGFRBPDGFRALRRK2
SCHEMBL14916575 0.89 GRIN1 (0.37) METPDGFRBPDGFRAPPARAGRIN2B
SCHEMBL10283774 0.89 LRRK2 (0.36) METPDGFRBPDGFRALRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593107-A1 TYROSINE KINASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2013-05-22 EP claimed
US-20130116231-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2013-05-09 US claimed
WO-2012009194-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2012-01-19 WO claimed
US-20130116231-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2013-05-09 US disclosed
US-20130116231-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2013-05-09 US disclosed
US-20130116231-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2013-05-09 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 (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-20130116231-A1 TYROSINE KINASE INHIBITORS ABL1, ERBB2, MET MET 3/4885KDM4E 429/4885ALDH1A1 762/4885

“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.