SCHEMBL15870319

SCHEMBL15870319

C=NNN1CC(Oc2ccc(Nc3cc(Br)cn(C)c3=O)nc2)C1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 7/20 0.39
▸ PIK3CA P42336 6/20 0.33
▸ PRKDC P78527 5/20 0.33
▸ CSF1R P07333 2/20 0.32
▸ ACACB O00763 4/20 0.32
▸ CCNE1 P24864 1/20 0.31
▸ CDK2 P24941 1/20 0.31
▸ HSF1 Q00613 1/20 0.31
▸ MTOR P42345 2/20 0.30
▸ PIK3CD O00329 1/20 0.30
▸ PIK3CB P42338 1/20 0.30
▸ MAPK9 P45984 1/20 0.30
▸ PIK3CG P48736 1/20 0.30
▸ MAPK10 P53779 1/20 0.30
▸ ATM Q13315 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
SCHEMBL29741802 0.87 BTK (0.47) BTKPIK3CAPRKDCCSF1RACACB
SCHEMBL1726359 0.87 BTK (0.47) BTKPIK3CAPRKDCCSF1RACACB
SCHEMBL14930421 0.85 BTK (0.41) BTKPIK3CAPRKDCCSF1RACACB
SCHEMBL10255875 0.83 BTK (0.41) BTKPIK3CAPRKDCCSF1RCCNE1
SCHEMBL10255885 0.83 BTK (0.41) BTKCSF1RCCNE1CDK2HSF1
SCHEMBL14912471 0.83 BTK (0.41) BTKPIK3CAPRKDCCSF1RACACB
Hydrochloric Acid SCHEMBL14913480 0.82 BTK (0.40) BTKCSF1RCCNE1CDK2HSF1
SCHEMBL10256055 0.79 PIK3CA (0.42) BTKPIK3CAPRKDCMTORPIK3CD
SCHEMBL30512276 0.79 PIK3CA (0.42) BTKPIK3CAPRKDCMTORPIK3CD
SCHEMBL24374769 0.78 BTK (0.43) BTKPIK3CAPRKDCMTOR

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-8921353-B2 Heteroaryl pyridone and aza-pyridone compounds GENENTECH, INC. (US) 2014-12-30 — — US disclosed
US-20140194408-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS GENENTECH, INC. (US) 2014-07-10 — — 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-20140194408-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS BTK, PDXK, TYK2 BTK 1/4885PIK3CA 74/4885PRKDC 244/4885

“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.

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