SCHEMBL2954044

SCHEMBL2954044

CNc1noc2c(-c3ccc4c(-c5ccccc5C)nncc4c3)c(C)ccc12

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.78
CYP3A4 P08684 8/20 0.78
KIT P10721 4/20 0.56
PDGFRB P09619 1/20 0.56
KCNH2 Q12809 1/20 0.56
MAPK11 Q15759 1/20 0.56
MAPK9 P45984 1/20 0.48
MAPK10 P53779 1/20 0.48
LCK P06239 2/20 0.41
KDR P35968 2/20 0.41

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
SCHEMBL2944546 0.89 MAPK14 (0.63) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2949265 0.88 MAPK14 (1.00) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2953472 0.80 MAPK14 (1.00) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2953142 0.78 MAPK14 (1.00) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2944392 0.77 MAPK14 (1.00) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2954064 0.77 MAPK14 (1.00) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2945976 0.76 MAPK14 (0.60) MAPK14CYP3A4KITMAPK9MAPK10
SCHEMBL2949807 0.76 MAPK14 (0.79) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2952397 0.75 MAPK14 (0.83) MAPK14CYP3A4KITPDGFRBKCNH2
SCHEMBL2947400 0.74 MAPK14 (0.80) MAPK14CYP3A4KITPDGFRBKCNH2

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-1856058-B1 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2014-09-03 EP claimed
US-7759337-B2 Phthalazine compounds and methods of use AMGEN INC. (US) 2010-07-20 US claimed
EP-1856058-A2 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-11-21 EP claimed
WO-2006094187-A2 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2006-09-08 WO claimed
US-20060199817-A1 Phthalazine, aza- and diaza-phthalazine compounds and methods of use AMGEN INC. (US) 2006-09-07 US claimed
EP-1856058-B1 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2014-09-03 EP 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-20060199817-A1 Phthalazine, aza- and diaza-phthalazine compounds and methods of use DAPK2, CDK2, DAPK1 MAPK14 293/4885CYP3A4 2740/4885KIT 1977/4885

“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.