SCHEMBL19630405

SCHEMBL19630405

COc1ccccc1-c1ccc2ccc3ccc(-c4cccc(-n5c6ccccc6c6ccccc65)c4)nc3c2n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ HTR7 P34969 1/20 0.40
▸ PDE10A Q9Y233 1/20 0.39
▸ GRM5 P41594 1/20 0.39
▸ MAP4K1 Q92918 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ FYN P06241 4/20 0.37
▸ FLT3 P36888 1/20 0.37
▸ BMX P51813 1/20 0.37
▸ ACACA Q13085 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ PTPN1 P18031 1/20 0.35
▸ SQOR Q9Y6N5 1/20 0.35

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
SCHEMBL19644943 0.93 TSPO (0.38) MAOAMAOBHTR7PDE10AGRM5
SCHEMBL19630399 0.92 PDE10A (0.38) MAOAMAOBHTR7PDE10AGRM5
SCHEMBL19645007 0.87 MAOA (0.33) MAOAMAOBHTR7PDE10AGRM5
SCHEMBL19645002 0.84 PDE10A (0.38) MAOAMAOBPDE10AALDH1A1FYN
SCHEMBL19630359 0.84 NT5E (0.38) PDE10AGRM5MAP4K1MAPTTDP1
SCHEMBL19644612 0.81 KDM4E (0.35) PDE10AACACAKDM4E
SCHEMBL19630385 0.80 NT5E (0.35) PDE10AGRM5MAP4K1MAPTTDP1
SCHEMBL19644942 0.79 ALDH1A1 (0.38) PDE10AMAP4K1ALDH1A1MAPTTDP1
SCHEMBL19645003 0.79 GRM5 (0.40) MAOBPDE10AGRM5ALDH1A1SMN1; SMN2
SCHEMBL14554527 0.77 L3MBTL1 (0.44) HTR7PDE10AALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106986870-B Organic electric field color changing device and o-diazaphenanthrene based compound used for the same 机光科技股份有限公司 2019-07-12 — — CN disclosed
US-9831444-B1 Phenanthroline-based compound for organic electroluminescence device UDC IRELAND LIMITED (IE) 2017-11-28 — — US disclosed
US-9831444-B1 Phenanthroline-based compound for organic electroluminescence device UDC IRELAND LIMITED (IE) 2017-11-28 — — US disclosed
US-9831444-B1 Phenanthroline-based compound for organic electroluminescence device UDC IRELAND LIMITED (IE) 2017-11-28 — — US disclosed
CN-106986870-A Organic electric field color changing device and o-diazaphenanthrene based compound used for the same 机光科技股份有限公司 2017-07-28 — — CN disclosed
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