SCHEMBL358892

SCHEMBL358892

COc1ccc2cc(OCc3nn(-c4cnn(C)c4)ccc3=O)ccc2n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.41
FGFR3 P22607 15/20 0.35
FGFR1 P11362 14/20 0.35
FGFR2 P21802 14/20 0.35
PDE4A P27815 2/20 0.35
PDE4B Q07343 2/20 0.35
PDE3B Q13370 2/20 0.35
PDE3A Q14432 2/20 0.35
FGFR4 P22455 12/20 0.34
KDR P35968 12/20 0.34
LRRK2 Q5S007 1/20 0.33
FLT3 P36888 1/20 0.33
PPARG P37231 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
SCHEMBL361506 0.89 PDE10A (0.42) PDE10AFGFR3FGFR1FGFR2PDE4A
SCHEMBL359817 0.87 MET (0.40) PDE10AFGFR3FGFR1FGFR2FGFR4
SCHEMBL162668 0.85 MET (0.43) PDE10APDE3BPDE3A
SCHEMBL255618 0.83 PDE10A (0.38) PDE10AFGFR3FGFR1FGFR2FGFR4
SCHEMBL359481 0.83 EGFR (0.41) PDE10AFGFR3FGFR1FGFR2
SCHEMBL178094 0.83 MET (0.44) FGFR3FGFR1
SCHEMBL360598 0.83 PDE10A (0.38) PDE10AFGFR3FGFR1
SCHEMBL367900 0.83 MET (0.39) PDE10AFGFR3FGFR1FGFR2KDR
SCHEMBL14915754 0.82 PDE10A (0.38) PDE10AFGFR3FGFR1FGFR2FLT3
SCHEMBL367903 0.82 MET (0.40) PDE10AFGFR3FGFR1FGFR2PDE3B

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 9 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
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 PDE10A 3303/4885FGFR3 199/4885FGFR1 58/4885

“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.