SCHEMBL4833236

SCHEMBL4833236

COc1cccc(-c2n[nH]c3nc(Oc4ccc(F)cc4F)nc(NCC(C)O)c23)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.41
MAPK11 Q15759 1/20 0.39
MAPT P10636 2/20 0.37
ADORA2A P29274 1/20 0.37
NTRK1 P04629 1/20 0.36
PDE4B Q07343 3/20 0.36
MAPK8 P45983 1/20 0.36
MET P08581 4/20 0.36
AXL P30530 4/20 0.36
TYRO3 Q06418 4/20 0.36
MERTK Q12866 4/20 0.36
TP53 P04637 1/20 0.35
CTSA P10619 1/20 0.34

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
SCHEMBL14018824 1.00 MAPK14 (0.41) MAPK14MAPK11MAPTADORA2ANTRK1
SCHEMBL4837283 0.91 MAPK14 (0.43) MAPK14MAPK11MAPTNTRK1MAPK8
SCHEMBL14018827 0.91 MAPK14 (0.43) MAPK14MAPK11MAPTNTRK1MAPK8
SCHEMBL4020253 0.90 MAPK14 (0.45) MAPK14MAPK11METAXLTYRO3
SCHEMBL4837394 0.88 MAPK14 (0.42) MAPK14MAPK11MAPK8METAXL
SCHEMBL14018830 0.88 MAPK14 (0.42) MAPK14MAPK11MAPK8METAXL
SCHEMBL14018923 0.87 MAPK14 (0.41) MAPK14MAPK11MAPK8METAXL
SCHEMBL4833200 0.87 MAPK14 (0.41) MAPK14MAPK11MAPK8METAXL
SCHEMBL4840327 0.86 MAPK14 (0.41) MAPK14MAPK11MAPK8METAXL
SCHEMBL14018829 0.86 MAPK14 (0.41) MAPK14MAPK11MAPK8METAXL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7435731-B2 Substituted pyrazolo[3,4-d]pyrimadines and methods of using the same ROCHE PALO ALTO LLC (US) 2008-10-14 US claimed
US-7435731-B2 Substituted pyrazolo[3,4-d]pyrimadines and methods of using the same ROCHE PALO ALTO LLC (US) 2008-10-14 US disclosed
US-20050197340-A1 Fused-pyrazolo pyrimidine and pyrazolo pyrimidinone derivatives and methods for using the same ROCHE PALO ALTO LLC 2005-09-08 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-20050197340-A1 Fused-pyrazolo pyrimidine and pyrazolo pyrimidinone derivatives and methods for using the same MAP3K1, MAPK1, MAP3K8 MAPK14 70/4885MAPK11 75/4885MAPT 2924/4885

“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.