SCHEMBL25645407

SCHEMBL25645407

c1ccc(N(c2ccccc2)c2ccc3c(c2)sc2ccc4c5ccccc5oc4c23)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.35
▸ HPGD P15428 5/20 0.34
▸ MAPT P10636 4/20 0.34
▸ KDM4E B2RXH2 4/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ CASP3 P42574 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ ALPI P09923 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ CASP7 P55210 1/20 0.34
▸ CASP6 P55212 1/20 0.34
▸ MCL1 Q07820 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ AHR P35869 2/20 0.33
▸ ALDH1A1 P00352 4/20 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
SCHEMBL25645394 0.96 AHR (0.35) ALOX5HPGDMAPTKDM4EMEN1
SCHEMBL25645386 0.95 PLA2G2A (0.34) ALOX5HPGDMAPTKDM4EMEN1
SCHEMBL25640595 0.90 LMNA (0.33) HPGDMAPTKDM4EMEN1KMT2A
SCHEMBL23598100 0.89 ALOX5 (0.34) ALOX5HPGDMAPTKDM4EMEN1
SCHEMBL23268734 0.89 ALOX5 (0.32) ALOX5AHR
SCHEMBL25645376 0.88 ALOX5 (0.34) ALOX5HPGDMAPTKDM4EMEN1
SCHEMBL25640645 0.88 DUSP3 (0.32) HPGDMAPTKDM4EMEN1KMT2A
SCHEMBL25640501 0.88 L3MBTL1 (0.34) HPGDMAPTKDM4EMEN1KMT2A
SCHEMBL25640527 0.88 TDP1 (0.34) HPGDMAPTKDM4EMEN1KMT2A
SCHEMBL24000197 0.87 AHR (0.38) HPGDMAPTKDM4EMEN1KMT2A

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-2023113334-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DIODE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2023-06-22 — — WO disclosed
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