SCHEMBL16631753

SCHEMBL16631753

CCn1cc2c(=O)cc[nH]c2nc1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 3/20 0.49
ADORA1 P30542 2/20 0.49
KDM4E B2RXH2 2/20 0.36
CCR8 P51685 1/20 0.35
DYRK1A Q13627 1/20 0.35
KMT2A Q03164 3/20 0.34
CCNK O75909 2/20 0.33
CDK12 Q9NYV4 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GLA P06280 1/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33
MEN1 O00255 1/20 0.31
ABCC4 O15439 1/20 0.31
LMNA P02545 1/20 0.31
PKM P14618 1/20 0.31
PTGS1 P23219 1/20 0.31
HSD17B10 Q99714 2/20 0.30
PRKACA P17612 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
SCHEMBL16631757 0.85 ADORA2A (0.46) ADORA2AADORA1KDM4ECCR8DYRK1A
SCHEMBL18081979 0.79 ADORA2A (0.53) ADORA2AADORA1KDM4ECCR8DYRK1A
SCHEMBL18080573 0.75 ADORA2A (0.50) ADORA2AADORA1KDM4ECCR8DYRK1A
SCHEMBL16631756 0.73 ADORA1 (0.34) ADORA2AADORA1LMNA
SCHEMBL18081928 0.70 ADORA2A (0.50) ADORA2AADORA1KDM4ECCR8DYRK1A
SCHEMBL811103 0.68 ADORA2A (0.47) ADORA2AADORA1KDM4ECCR8KMT2A
SCHEMBL16631558 0.68 SMN1; SMN2 (0.32) KMT2ASMN1; SMN2ALDH1A1MEN1ABCC4
SCHEMBL16631774 0.68 MEN1 (0.33) KDM4EKMT2ASMN1; SMN2ALDH1A1MEN1
SCHEMBL16631758 0.67 LMNA (0.30) LMNA
SCHEMBL18080575 0.67 ADORA2A (0.48) ADORA2AADORA1KDM4ECCR8DYRK1A

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-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 WO disclosed