SCHEMBL16969008

SCHEMBL16969008

c1ccc(Cn2cc(-c3cnc4[nH]cc(-c5cnn(Cc6ccccc6)c5)c4n3)cn2)cc1

nearest known ligand 0.86

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 10/20 0.86
ALK Q9UM73 6/20 0.57
L3MBTL1 Q9Y468 2/20 0.50
MKNK1 Q9BUB5 1/20 0.46
PIK3CD O00329 1/20 0.45

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
SCHEMBL15653554 0.94 MAPK1 (0.76) MAPK1ALK
SCHEMBL15652538 0.92 MAPK1 (1.00) MAPK1ALKL3MBTL1MKNK1
SCHEMBL15652056 0.92 MAPK1 (0.76) MAPK1ALKL3MBTL1
SCHEMBL15653479 0.89 MAPK1 (0.79) MAPK1ALKMKNK1
SCHEMBL15652637 0.89 MAPK1 (0.79) MAPK1ALKL3MBTL1MKNK1
SCHEMBL15653094 0.89 MAPK1 (0.79) MAPK1ALKPIK3CD
SCHEMBL15654007 0.87 MAPK1 (0.70) MAPK1ALKMKNK1
SCHEMBL15607460 0.87 MAPK1 (0.70) MAPK1ALK
SCHEMBL15653225 0.87 MAPK1 (0.69) MAPK1ALKL3MBTL1PIK3CD
SCHEMBL15653713 0.87 MAPK1 (0.69) MAPK1ALKL3MBTL1PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9382257-B2 Substituted pyrrolo[2,3-b]pyrazines as serine/threonine kinase inhibitors GENENTECH, INC. (US) 2016-07-05 US disclosed
US-20150218176-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2015-08-06 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-20150218176-A1 SERINE/THREONINE KINASE INHIBITORS MAP3K1, MAP3K2, MAP3K20 MAPK1 29/4885ALK 896/4885L3MBTL1 1409/4885

“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.