SCHEMBL19965792

SCHEMBL19965792

Cc1cncc(Br)c1C=O

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 2/20 0.32
PRKDC P78527 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
AOX1 Q06278 1/20 0.31
CCNC P24863 1/20 0.30
CDK8 P49336 1/20 0.30
TRIM24 O15164 1/20 0.30
TRIM33 Q9UPN9 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
SCHEMBL1044209 0.84 ALDH1A1 (0.35) ERN1KDM4EMEN1ALDH1A1LMNA
SCHEMBL567898 0.84 CCNC (0.34) ERN1PRKDCCCNCCDK8
SCHEMBL1563913 0.74 ALDH1A1 (0.38) ERN1MEN1ALDH1A1KMT2ACCNC
SCHEMBL6920756 0.74 MEN1 (0.38) KDM4EMEN1ALDH1A1LMNAHPGD
SCHEMBL29923236 0.74 CCNC (0.33) ERN1CCNCCDK8
SCHEMBL782488 0.74 CA1 (0.31) CCNCCDK8
SCHEMBL30702047 0.74 CA1 (0.31) CCNCCDK8
SCHEMBL15144851 0.74 ERN1 (0.31) ERN1KDM4EMEN1ALDH1A1LMNA
SCHEMBL17508485 0.74 HPGD (0.33) MEN1ALDH1A1LMNAHPGDKMT2A
SCHEMBL17508483 0.74 HPGD (0.33) MEN1ALDH1A1LMNAHPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180071286-A1 HETEROARYL PYRIDONE AND AZA-PYRODINE COMPOUNDS GENENTECH, INC. (US) 2018-03-15 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-20180071286-A1 HETEROARYL PYRIDONE AND AZA-PYRODINE COMPOUNDS TYK2, BTK, PDXK ERN1 1402/4885PRKDC 64/4885KDM4E 1084/4885

“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.