SCHEMBL369463

SCHEMBL369463

Cn1cc(-n2ccc(=O)c(COc3ccc4ncc5c(c4c3)OCCO5)n2)cn1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MET P08581 9/20 0.41
PDE10A Q9Y233 1/20 0.33
NMT1 P30419 2/20 0.31
NMT2 O60551 1/20 0.31
MCHR1 Q99705 2/20 0.30
MST1R Q04912 2/20 0.30
ACVR1 Q04771 1/20 0.30
FGFR1 P11362 1/20 0.30
FGFR2 P21802 1/20 0.30
FGFR3 P22607 1/20 0.30
KCNH2 Q12809 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
SCHEMBL360549 0.81 MET (0.36) METPDE10AMCHR1MST1RACVR1
SCHEMBL359318 0.80 MET (0.38) METPDE10AMCHR1ACVR1
SCHEMBL359783 0.80 MET (0.35) METPDE10AACVR1
SCHEMBL359286 0.80 MET (0.39) METPDE10AFGFR1FGFR2FGFR3
SCHEMBL14915754 0.80 PDE10A (0.38) METPDE10AFGFR1FGFR2FGFR3
SCHEMBL369336 0.79 MET (0.39) METPDE10AACVR1
SCHEMBL178094 0.78 MET (0.44) METFGFR1FGFR3
SCHEMBL255618 0.78 PDE10A (0.38) METPDE10AFGFR1FGFR2FGFR3
SCHEMBL359817 0.78 MET (0.40) METPDE10AFGFR1FGFR2FGFR3
SCHEMBL360598 0.78 PDE10A (0.38) METPDE10AFGFR1FGFR3

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-20130116231-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2013-05-09 US claimed
EP-2593107-A1 TYROSINE KINASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2013-05-22 EP 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
US-20130116231-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2013-05-09 US disclosed
WO-2012009194-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2012-01-19 WO disclosed
WO-2012009194-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2012-01-19 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-20130116231-A1 TYROSINE KINASE INHIBITORS ABL1, ERBB2, MET MET 3/4885PDE10A 3303/4885NMT1 3022/4885

“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.