SCHEMBL5481694

SCHEMBL5481694

Cc1ccccc1N1C(=O)CCN(Cc2ccc(NC(=O)Nc3cc(C(C)(C)C)no3)cc2)C1=O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.50
RAF1 P04049 2/20 0.44
NTRK1 P04629 2/20 0.42
RET P07949 1/20 0.42
EPHB2 P29323 1/20 0.42
KDR P35968 1/20 0.42
MAPK13 O15264 2/20 0.41
MAPK12 P53778 1/20 0.41
MAPK11 Q15759 1/20 0.41
POLB P06746 1/20 0.39
ALDH1A1 P00352 1/20 0.39
NTRK3 Q16288 1/20 0.39
NTRK2 Q16620 1/20 0.39
CNR2 P34972 3/20 0.38
NEK7 Q8TDX7 2/20 0.38
BRAF P15056 1/20 0.38
FLT3 P36888 2/20 0.38

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
SCHEMBL5478409 0.86 MEN1 (0.51) MAPK14RAF1RETKDRMAPK13
SCHEMBL5473558 0.85 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5474658 0.84 POLB (0.44) MAPK14MAPK13MAPK12MAPK11POLB
SCHEMBL5480272 0.81 MAPK14 (0.58) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5481591 0.80 MAPK14 (0.59) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5475317 0.80 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11BRAF
SCHEMBL5486129 0.80 MAPK14 (0.55) MAPK14MAPK13MAPK12MAPK11
SCHEMBL1979544 0.73 MAPK14 (0.59) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5476050 0.72 MAPK14 (0.58) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5486881 0.72 MAPK14 (0.54) MAPK14MAPK13MAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070010529-A1 Nitrogenous heterocyclic compounds and medical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-01-11 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-20070010529-A1 Nitrogenous heterocyclic compounds and medical use thereof MAPK1, NOS1, NOS2 MAPK14 12/4885RAF1 538/4885NTRK1 1442/4885

“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.