SCHEMBL27323906

SCHEMBL27323906

C=CC(=N)c1ccc2c(c1)oc1ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.49
HTR2B P41595 1/20 0.48
AHR P35869 2/20 0.46
MEN1 O00255 6/20 0.45
KMT2A Q03164 6/20 0.45
HPGD P15428 5/20 0.45
MAPT P10636 4/20 0.45
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 3/20 0.45
MAOA P21397 1/20 0.41
SMN1; SMN2 Q16637 6/20 0.39
HSD17B10 Q99714 2/20 0.39
LMNA P02545 2/20 0.39
RAB9A P51151 6/20 0.39
NPC1 O15118 5/20 0.39
PTGER4 P35408 1/20 0.39
GAA P10253 2/20 0.38
DUSP3 P51452 1/20 0.38
HTT P42858 2/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL23869908 0.78 TTR (0.53) TTRHTR2BAHRMEN1KMT2A
SCHEMBL21583592 0.78 HTR2B (0.49) TTRHTR2BAHRMEN1KMT2A
SCHEMBL3066191 0.75 TTR (0.50) TTRHTR2BAHRMEN1KMT2A
SCHEMBL24628907 0.75 TTR (0.44) TTRHTR2BAHRMEN1KMT2A
SCHEMBL24178262 0.75 TTR (0.53) TTRHTR2BAHRMEN1KMT2A
SCHEMBL15040953 0.74 TTR (0.56) TTRHTR2BAHRMEN1KMT2A
SCHEMBL15041016 0.74 TTR (0.65) TTRHTR2BAHRMEN1KMT2A
SCHEMBL15041013 0.74 TTR (0.65) TTRHTR2BAHRMEN1KMT2A
SCHEMBL23229541 0.73 TTR (0.51) TTRHTR2BAHRMEN1KMT2A
SCHEMBL24285613 0.73 TTR (0.55) TTRHTR2BAHRMEN1KMT2A

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-2024085588-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2024-04-25 WO disclosed