SCHEMBL26164351

SCHEMBL26164351

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3Oc3ccc(N(c5ccccc5)c5ccccc5)c5cccc-4c35)n2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPK1 P28482 2/20 0.33
ATM Q13315 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PDE5A O76074 3/20 0.33
ABCG2 Q9UNQ0 3/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ADORA3 P0DMS8 1/20 0.32

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
SCHEMBL26164354 0.97 KDM1A (0.33) TSHRKDM4EMAPK1ATMALDH1A1
SCHEMBL26164352 0.92 ALDH1A1 (0.31) TSHRKDM4EMAPK1ATMALDH1A1
SCHEMBL26164357 0.90 KDM4E (0.33) TSHRKDM4EMAPK1ATMALDH1A1
SCHEMBL26164355 0.88
SCHEMBL26164359 0.88 ADK (0.31) TSHRKDM4EMAPK1ALDH1A1MAPT
SCHEMBL26164279 0.87 TSHR (0.33) TSHRKDM4EMAPK1ATMALDH1A1
SCHEMBL26164358 0.85 KDM1A (0.33) TSHRKDM4EMAPK1ATMALDH1A1
SCHEMBL26164827 0.85 KDM4E (0.33) TSHRKDM4EMAPK1ATMALDH1A1
SCHEMBL26164302 0.84 TSHR (0.32) TSHRKDM4EMAPK1ATMALDH1A1
SCHEMBL26164711 0.84 MAPK1 (0.34) TSHRKDM4EMAPK1ATMALDH1A1

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-2023096225-A1 HETEROCYCLIC COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE AND COMPOSITION FOR FORMING ORGANIC MATERIAL LAYER, COMPRISING SAME 엘티소재주식회사 2023-06-01 WO disclosed