SCHEMBL10183063

SCHEMBL10183063

CC(C)(C)c1cnn2cc(-c3cc(F)nc(F)c3)ccc12

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KIT P10721 3/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
TRPA1 O75762 1/20 0.32
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SCN5A Q14524 1/20 0.31
NR3C1 P04150 1/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPK1 P28482 1/20 0.30
DYRK1A Q13627 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
SCHEMBL10182971 0.85 JAK1 (0.40) KITMAPT
SCHEMBL10182956 0.83 JAK1 (0.38) KITMAPTDYRK1A
SCHEMBL10182940 0.81 JAK1 (0.38) KIT
SCHEMBL21849672 0.80 NR3C1 (0.35) KITPTGS1PTGS2NR3C1
SCHEMBL10182972 0.78 PIK3CG (0.37)
SCHEMBL10183055 0.78 KIF11 (0.44) MAPTDYRK1A
SCHEMBL10233666 0.77 ACVR2A (0.32) MAPTL3MBTL1ALDH1A1MAPK1DYRK1A
SCHEMBL10183085 0.75 ALOX5AP (0.40) MAPT
SCHEMBL10182958 0.74 KIF11 (0.50) L3MBTL1ALDH1A1
SCHEMBL10183057 0.74 BMP4 (0.37) PTGS2

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-20120040951-A1 HETEROARYL COMPOUNDS USEFUL AS RAF KINASE INHIBITORS SUNESIS PHARMACEUTICALS, INC. 2012-02-16 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-20120040951-A1 HETEROARYL COMPOUNDS USEFUL AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF KIT 1799/4885PTGS1 3150/4885PTGS2 3226/4885

“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.