SCHEMBL21870925

SCHEMBL21870925

BrC1C=CC(c2nc(Cc3ccccc3)cc(-c3ccccc3)n2)=CC1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ASIC3 Q9UHC3 1/20 0.32
▸ BRD4 O60885 4/20 0.32
▸ HTR2B P41595 3/20 0.32
▸ XDH P47989 1/20 0.32
▸ PSD A5PKW4 2/20 0.31
▸ HRH4 Q9H3N8 1/20 0.31
▸ GSK3B P49841 1/20 0.31
▸ NR1H2 P55055 1/20 0.31
▸ NR1H3 Q13133 1/20 0.31
▸ MAPK1 P28482 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
SCHEMBL22109950 0.79 L3MBTL1 (0.39) ALDH1A1L3MBTL1TDP1RAB9AMEN1
SCHEMBL19831411 0.73 MEN1 (0.53) ALDH1A1SMN1; SMN2L3MBTL1TDP1RAB9A
SCHEMBL20088892 0.69 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2TDP1RAB9AMAPK1
SCHEMBL28013041 0.67 ADORA2A (0.63) ALDH1A1SMN1; SMN2TDP1RAB9AMEN1
SCHEMBL21882621 0.66 MEN1 (0.39) ALDH1A1TDP1MEN1KMT2AHPGD
SCHEMBL16856512 0.65 MEN1 (0.34) ALDH1A1SMN1; SMN2L3MBTL1TDP1MEN1
SCHEMBL18867189 0.64 CYP19A1 (0.30) —
SCHEMBL24622697 0.64 TDP1 (0.44) ALDH1A1SMN1; SMN2L3MBTL1TDP1RAB9A
SCHEMBL21882494 0.62 MEN1 (0.40) ALDH1A1TDP1MEN1KMT2AHPGD
SCHEMBL18698100 0.62 L3MBTL1 (0.43) ALDH1A1L3MBTL1TDP1RAB9AMEN1

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-2020067595-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 희성소재(주) 2020-04-02 — — WO disclosed
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