SCHEMBL25640501

SCHEMBL25640501

c1ccc(N(c2ccc3c(c2)oc2ccccc23)c2ccc3c(c2)sc2ccc4c(oc5ccc6ccccc6c54)c23)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.34
▸ TDP1 Q9NUW8 2/20 0.34
▸ DUSP3 P51452 1/20 0.32
▸ AHR P35869 2/20 0.32
▸ CYP1A2 P05177 2/20 0.32
▸ CYP1A1 P04798 1/20 0.32
▸ FYN P06241 1/20 0.32
▸ MAPK3 P27361 1/20 0.32
▸ PAX8 Q06710 1/20 0.32
▸ ABCG2 Q9UNQ0 1/20 0.32
▸ KDM4E B2RXH2 3/20 0.31
▸ MAPT P10636 3/20 0.31
▸ HPGD P15428 3/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ ALPI P09923 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ PKM P14618 1/20 0.31

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
SCHEMBL25640527 0.96 TDP1 (0.34) L3MBTL1TDP1DUSP3AHRCYP1A2
SCHEMBL25640526 0.95 ABCG2 (0.34) L3MBTL1TDP1DUSP3AHRCYP1A2
SCHEMBL25640075 0.95 L3MBTL1 (0.33) L3MBTL1TDP1DUSP3AHRCYP1A2
SCHEMBL25640541 0.94 ABCG2 (0.35) L3MBTL1TDP1AHRCYP1A2CYP1A1
SCHEMBL25640645 0.92 DUSP3 (0.32) L3MBTL1TDP1DUSP3AHRCYP1A2
SCHEMBL25640132 0.92 TDP1 (0.34) L3MBTL1TDP1DUSP3AHRCYP1A2
SCHEMBL25645394 0.91 AHR (0.35) L3MBTL1TDP1AHRKDM4EMAPT
SCHEMBL25731586 0.90 IKBKB (0.33) L3MBTL1TDP1AHRCYP1A2CYP1A1
SCHEMBL25640500 0.89 ABCG2 (0.38) L3MBTL1TDP1AHRCYP1A2CYP1A1
SCHEMBL25642691 0.89 TDP1 (0.35) L3MBTL1TDP1DUSP3AHRCYP1A2

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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