SCHEMBL24907678

SCHEMBL24907678

N=C(/N=C(\N)c1cccc2oc3ccccc3c12)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
GLA P06280 2/20 0.43
HTR2B P41595 1/20 0.37
MAPT P10636 4/20 0.35
KMT2A Q03164 3/20 0.35
NPC1 O15118 2/20 0.35
MAOA P21397 2/20 0.35
CDC14B O60729 2/20 0.34
CDC14A Q9UNH5 2/20 0.34
EPM2A O95278 1/20 0.34
PTPRC P08575 1/20 0.34
PTPN2 P17706 1/20 0.34
PTPN1 P18031 1/20 0.34
ACP1 P24666 1/20 0.34
PTPN6 P29350 1/20 0.34
PTPN7 P35236 1/20 0.34
PTPN5 P54829 1/20 0.34
PTPN11 Q06124 1/20 0.34
PTPN13 Q12923 1/20 0.34
DUSP23 Q9BVJ7 1/20 0.34

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
SCHEMBL25008980 0.92 WDR5 (0.40) ALDH1A1GLAHTR2BCDC14BCDC14A
SCHEMBL25507560 0.90 ALDH1A1 (0.46) ALDH1A1GLAHTR2BMAPTKMT2A
SCHEMBL24971831 0.89 ALDH1A1 (0.43) ALDH1A1GLAHTR2BMAPTKMT2A
SCHEMBL25654459 0.87 HTR2B (0.36) ALDH1A1GLAHTR2BMAPTKMT2A
SCHEMBL24315343 0.86 AHR (0.43) ALDH1A1GLAHTR2BMAPTKMT2A
SCHEMBL24655499 0.86 PRSS1 (0.40) ALDH1A1GLAHTR2BMAPTPLG
SCHEMBL22992123 0.86 MAPT (0.38) ALDH1A1GLAHTR2BMAPTKMT2A
SCHEMBL23627157 0.85 ALOX5 (0.39) ALDH1A1GLAHTR2BMAPTKMT2A
SCHEMBL24658033 0.85 F2 (0.42) ALDH1A1GLAHTR2BMAPTKMT2A
SCHEMBL26064331 0.85 AHR (0.41) ALDH1A1GLAMAPTNPC1CDC14B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4289836-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME Lg Chem, Ltd. (KR) 2023-12-13 EP disclosed
WO-2023003436-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed