SCHEMBL29950680

SCHEMBL29950680

N#Cc1cccc(Cl)c1B(O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.41
ENPP2 Q13822 2/20 0.37
GRIA1 P42261 1/20 0.36
CACNG8 Q8WXS5 1/20 0.36
LDHA P00338 2/20 0.35
LDHB P07195 2/20 0.35
TSHR P16473 1/20 0.34
TRPV4 Q9HBA0 1/20 0.34
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
TAS1R2 Q8TE23 1/20 0.33
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
GAA P10253 2/20 0.33
ALOX15 P16050 2/20 0.33
HSD17B10 Q99714 2/20 0.33
PSMB8 P28062 4/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL5784673 0.85 ENPP2 (0.43) ENPP2TSHRKDM4EALDH1A1CA1
SCHEMBL5649 0.78 CYP1A2 (0.43) ENPP2TSHRALDH1A1MEN1KMT2A
SCHEMBL25493988 0.78 ENPP2 (0.38) ENPP2TSHRALDH1A1ALOX15HSD17B10
Boric Acid SCHEMBL29171863 0.77 TSHR (0.43) DYRK1ATSHRTRPV4KDM4EALDH1A1
SCHEMBL29741613 0.76 TSHR (0.54) ENPP2LDHALDHBTSHRKDM4E
SCHEMBL1668130 0.76 ENPP2 (0.37) ENPP2TSHRTRPV4CA1CA2
SCHEMBL29950793 0.76 ENPP2 (0.37) ENPP2TSHRTRPV4CA1CA2
SCHEMBL3938143 0.72 DYRK1A (0.44) DYRK1AGRIA1CACNG8LDHALDHB
SCHEMBL29955943 0.72 TSHR (0.39) DYRK1AENPP2TSHRL3MBTL1
SCHEMBL19785358 0.72 TSHR (0.39) DYRK1AENPP2TSHRL3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119451947-A Compound and organic light emitting device comprising the same 株式会社LG化学 2025-02-14 CN disclosed
WO-2024167186-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2024-08-15 WO disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed