SCHEMBL16790980

SCHEMBL16790980

CC(C)COc1cccc(Nc2cc(Br)cn(C)c2=O)n1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 11/20 0.41
▸ SYK P43405 1/20 0.34
▸ TRIM24 O15164 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ MAPK8 P45983 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ TSPO P30536 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ OPRM1 P35372 1/20 0.31

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
SCHEMBL16790979 0.92 BTK (0.36) BTKSYKTSHRMAPK8TSPO
SCHEMBL16798105 0.92 BTK (0.36) BTKSYKTSHRMAPK8TSPO
Hydrochloric Acid SCHEMBL16766503 0.91 BTK (0.36) BTKSYKTSHRMAPK8TSPO
Hydrochloric Acid SCHEMBL16766505 0.91 BTK (0.36) BTKSYKTSHRMAPK8TSPO
SCHEMBL107748 0.88 MAPK8 (0.45) BTKMAPK8MAPT
SCHEMBL16790973 0.86 BRD4 (0.37) BTKTRIM24MAPK8
SCHEMBL16790985 0.85 BTK (0.35) BTKTRIM24MAPK8
SCHEMBL16766621 0.85 BTK (0.37) BTKSYKMAPK8
SCHEMBL16765885 0.84 BTK (0.53) BTK
SCHEMBL16802706 0.84 BTK (0.38) BTKSYKMAPK8

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-9260415-B2 Heteroaryl pyridone and aza-pyridone compounds with electrophilic functionality GENENTECH, INC. (US) 2016-02-16 — — US disclosed
US-20150158846-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS WITH ELECTROPHILIC FUNCTIONALITY GENENTECH, INC. (US) 2015-06-11 — — 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-20150158846-A1 HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS WITH ELECTROPHILIC FUNCTIONALITY BTK, TYK2, LCK BTK 1/4885SYK 7/4885TRIM24 3208/4885

“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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