SCHEMBL14285085

SCHEMBL14285085

COc1cccc(/C2=C3\C=CC(=N3)/C(c3cccc(OC)c3)=c3/cc/c([nH]3)=C(\c3cccc(OC)c3)C3=N/C(=C(/c4cccc(OC)c4)c4cc2cn4C)C=C3)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD9 Q9H8M2 1/20 0.41
▸ BRD4 O60885 2/20 0.39
▸ GSK3B P49841 6/20 0.36
▸ PRKCA P17252 4/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CDK5 Q00535 2/20 0.34
▸ CCNB2 O95067 1/20 0.34
▸ CDK1 P06493 1/20 0.34
▸ CCNB1 P14635 1/20 0.34
▸ GSK3A P49840 1/20 0.34
▸ CDK5R1 Q15078 1/20 0.34
▸ CCNB3 Q8WWL7 1/20 0.34
▸ EGLN2 Q96KS0 1/20 0.34
▸ CLK4 Q9HAZ1 3/20 0.33
▸ DCLK1 O15075 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
SCHEMBL14535750 0.86 BRD9 (0.32) BRD9
SCHEMBL14285088 0.86 TLR8 (0.41) BRD9BRD4GSK3BPRKCAALDH1A1
SCHEMBL14285082 0.85 NT5E (0.35) CCNB2CDK1CCNB1CCNB3
SCHEMBL433808 0.76 DYRK1A (0.49) GSK3BKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL17687649 0.70 DYRK1A (0.42) GSK3BKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL14535751 0.64 — —
SCHEMBL17681580 0.63 GCGR (0.41) CLK4DYRK1A
SCHEMBL498496 0.62 CYP1B1 (0.42) GSK3BALDH1A1KDM4ENPC1RAB9A
SCHEMBL28035340 0.61 IDO1 (0.64) BRD9BRD4GSK3BALDH1A1KDM4E
SCHEMBL1680192 0.59 ME2 (0.43) ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7319147-B2 Porphyrins and related compounds BIOSCIENCE TECHNOLOGY INVESTMENT HOLDINGS LIMITED (MY) 2008-01-15 — — US disclosed
US-7319147-B2 Porphyrins and related compounds BIOSCIENCE TECHNOLOGY INVESTMENT HOLDINGS LIMITED (MY) 2008-01-15 — — US disclosed
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