SCHEMBL23175129

SCHEMBL23175129

COc1ccc(Cc2nc(N)nc(N)n2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.70
SMN1; SMN2 Q16637 1/20 0.70
ALDH1A1 P00352 3/20 0.67
CYP2D6 P10635 1/20 0.67
ATM Q13315 1/20 0.67
HTT P42858 1/20 0.66
HSD17B10 Q99714 1/20 0.66
HTR6 P50406 1/20 0.63
NPSR1 Q6W5P4 1/20 0.56
LTA4H P09960 2/20 0.50
HPGD P15428 1/20 0.50
POLB P06746 2/20 0.49
MAPT P10636 2/20 0.48
KDM4E B2RXH2 1/20 0.48
NPC1 O15118 1/20 0.48
JAK2 O60674 1/20 0.48
PKM P14618 1/20 0.48
RAB9A P51151 1/20 0.48
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL3106262 0.90 ALDH1A1 (0.59) LMNASMN1; SMN2ALDH1A1CYP2D6ATM
SCHEMBL30281263 0.81 ALDH1A1 (0.57) LMNASMN1; SMN2ALDH1A1CYP2D6ATM
SCHEMBL30366498 0.80 ALDH1A1 (0.65) LMNASMN1; SMN2ALDH1A1CYP2D6ATM
SCHEMBL13730424 0.80 LTA4H (0.48) LMNASMN1; SMN2ALDH1A1CYP2D6ATM
SCHEMBL28605800 0.78 ALDH1A1 (0.50) LMNASMN1; SMN2ALDH1A1CYP2D6ATM
SCHEMBL28391873 0.78 ALDH1A1 (0.54) LMNASMN1; SMN2ALDH1A1CYP2D6ATM
SCHEMBL30617050 0.78 LTA4H (0.59) LMNASMN1; SMN2ALDH1A1CYP2D6ATM
SCHEMBL12495472 0.77 NPSR1 (0.83) LMNASMN1; SMN2ALDH1A1CYP2D6ATM
SCHEMBL34461806 0.77 ALDH1A1 (0.65) LMNASMN1; SMN2ALDH1A1CYP2D6ATM
SCHEMBL1081345 0.76 ALDH1A1 (0.53) LMNASMN1; SMN2ALDH1A1CYP2D6ATM

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-2021066088-A1 NOVEL TRIAZINE DERIVATIVE Meiji Seikaファルマ株式会社 2021-04-08 WO disclosed