SCHEMBL22246385

SCHEMBL22246385

Bc1nc(N)c(C=O)cc1Br

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 1/20 0.37
ERN1 O75460 3/20 0.34
LMNA P02545 1/20 0.34
TRIM24 O15164 1/20 0.31
TRIM33 Q9UPN9 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 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
SCHEMBL20657797 0.78 ERN1 (0.39) PRKDCERN1LMNACYP1A2CYP3A4
SCHEMBL14966255 0.78 ERN1 (0.31) PRKDCERN1
SCHEMBL2237276 0.72 PRKDC (0.58) PRKDCERN1LMNATRIM24TRIM33
SCHEMBL20657830 0.72 KMT2A (0.40) LMNA
SCHEMBL22246384 0.72 KMT2A (0.34) CYP3A4
SCHEMBL29950791 0.68 PRKDC (0.41) PRKDCERN1LMNATRIM24TRIM33
SCHEMBL790844 0.68 BACE1 (0.50) ERN1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL18382141 0.68 PRKDC (0.54) PRKDCERN1LMNATRIM24TRIM33
SCHEMBL31649818 0.67 ERN1 (0.48) PRKDCERN1LMNATRIM24TRIM33
SCHEMBL29952291 0.67 PRKDC (0.48) PRKDCERN1LMNATRIM24TRIM33

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
WO-2020150676-A1 1,8-NAPHTHYRIDINONE COMPOUNDS AND USES THEREOF NUVATION BIO INC. (US) 2020-07-23 WO disclosed