SCHEMBL4840993

SCHEMBL4840993

CC(O)C(CO)Nc1nc(Oc2ccc(F)cc2F)nc2[nH]nc(-c3ccccc3Cl)c12

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.43
MAPK11 Q15759 1/20 0.40
AXL P30530 7/20 0.34
TYRO3 Q06418 7/20 0.34
MERTK Q12866 7/20 0.34
MET P08581 3/20 0.34
DGAT2 Q96PD7 1/20 0.34
TRPA1 O75762 1/20 0.33
CTSA P10619 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
SCHEMBL14018892 1.00 MAPK14 (0.43) MAPK14MAPK11AXLTYRO3MERTK
SCHEMBL14018846 1.00 MAPK14 (0.43) MAPK14MAPK11AXLTYRO3MERTK
SCHEMBL14018866 1.00 MAPK14 (0.43) MAPK14MAPK11AXLTYRO3MERTK
SCHEMBL14018869 1.00 MAPK14 (0.43) MAPK14MAPK11AXLTYRO3MERTK
SCHEMBL4840856 0.92 MAPK14 (0.45) MAPK14MAPK11AXLTYRO3MERTK
SCHEMBL14018785 0.92 MAPK14 (0.45) MAPK14MAPK11AXLTYRO3MERTK
SCHEMBL4832594 0.90 MAPK14 (0.42) MAPK14MAPK11AXLTYRO3MERTK
SCHEMBL14019046 0.90 MAPK14 (0.47) MAPK14MAPK11AXLTYRO3MERTK
SCHEMBL4832963 0.90 MAPK14 (0.47) MAPK14MAPK11AXLTYRO3MERTK
SCHEMBL14018995 0.87 MAPK14 (0.42) MAPK14MAPK11TRPA1CTSA

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 75/4885AXL 493/4885

“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.