SCHEMBL30574582

SCHEMBL30574582

c1ccc(-c2ccc(N(c3ccccc3)c3cc(-c4ccccc4)cc(N(c4ccccc4)c4ccc5sc6ccccc6c5c4)c3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.40
▸ CYP1A2 P05177 2/20 0.36
▸ MAPT P10636 4/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ HPGD P15428 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ PTPN7 P35236 1/20 0.35
▸ DUSP3 P51452 1/20 0.35
▸ PTPN12 Q05209 1/20 0.35
▸ PTPN22 Q9Y2R2 1/20 0.35
▸ APP P05067 1/20 0.34
▸ TNKS O95271 1/20 0.34
▸ TNKS2 Q9H2K2 1/20 0.34
▸ PIM3 Q86V86 1/20 0.34
▸ PTGIR P43119 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ CYP3A4 P08684 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
SCHEMBL30574575 1.00 GPR3 (0.40) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL21984654 1.00 GPR3 (0.40) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL21984423 0.99 GPR3 (0.41) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL21984075 0.97 GPR3 (0.38) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL18164742 0.97 GPR3 (0.38) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL21984479 0.97 GPR3 (0.38) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL19660320 0.97 GPR3 (0.38) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL18164754 0.97 GPR3 (0.38) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL19801823 0.97 GPR3 (0.40) GPR3CYP1A2MAPTALDH1A1HPGD
SCHEMBL17369899 0.97 GPR3 (0.42) GPR3CYP1A2MAPTALDH1A1HPGD

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
CN-108218722-B Novel compound and organic light emitting device comprising the same 东进世美肯株式会社 2023-10-27 — — CN disclosed
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