SCHEMBL14463525

SCHEMBL14463525

O=C1NC(=O)c2c3ccccc3cc3cc(N4CCC4)cc1c23

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCB P05771 2/20 0.47
PRKCA P17252 2/20 0.47
PRKCH P24723 2/20 0.47
PRKCE Q02156 2/20 0.47
PRKCQ Q04759 2/20 0.47
PRKCD Q05655 2/20 0.47
CES1 P23141 1/20 0.40
PARP1 P09874 3/20 0.37
CDK2 P24941 1/20 0.36
ERBB2 P04626 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CDK4 P11802 2/20 0.34
CCND1 P24385 2/20 0.34
CRBN Q96SW2 1/20 0.34

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
SCHEMBL3079295 0.75 CES1 (0.63) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL31241414 0.75 CES1 (0.63) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL6405656 0.73 PARP1 (0.53) PRKCBPRKCACES1PARP1CDK2
SCHEMBL14463523 0.72 APAF1 (0.49) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL14463509 0.69 NPSR1 (0.52) PARP1MEN1KMT2ANPSR1
SCHEMBL8207983 0.68 PARP1 (0.50) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL14463439 0.68 NPSR1 (0.51) PARP1MEN1ALDH1A1KMT2AHSD17B10
SCHEMBL14463468 0.68 PRKCB (0.53) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL57037 0.66 DNMT1 (0.53) PRKCBPRKCACES1PARP1CDK2
SCHEMBL1654813 0.66 ALOX5 (0.51) PRKCBPRKCAPRKCHPRKCEPRKCQ

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-2007064345-A9 HETEROCYCLIC-SUBSTITUTED BIS-1,8 NAPHTHALIMIDE COMPOUNDS, ANTIBODY DRUG CONJUGATES, AND METHODS OF USE GENENTECH INC (US) 2007-07-12 WO disclosed