SCHEMBL6687798

SCHEMBL6687798

CCOC(=O)c1ccc(-c2c3nc(c(-c4ccccc4)c4ccc([nH]4)c(-c4ccccc4)c4nc(c(-c5ccccc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 3/20 0.61
▸ CYCS P99999 4/20 0.60
▸ ABCG2 Q9UNQ0 1/20 0.55
▸ RARA P10276 1/20 0.51
▸ RARB P10826 1/20 0.51
▸ RARG P13631 1/20 0.51
▸ RAB9A P51151 3/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ KDM4E B2RXH2 3/20 0.50
▸ MAPT P10636 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ LMNA P02545 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ HCRTR1 O43613 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ TUBB4A P04350 1/20 0.49

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
SCHEMBL12843222 0.94 CYCS (0.63) TOP1CYCSABCG2RAB9AALDH1A1
SCHEMBL3788647 0.86 TOP1 (0.66) TOP1CYCSABCG2RAB9AALDH1A1
SCHEMBL25046485 0.86 TOP1 (0.66) TOP1CYCSABCG2RAB9AALDH1A1
SCHEMBL30925006 0.86 TOP1 (0.66) TOP1CYCSABCG2RAB9AALDH1A1
SCHEMBL6688602 0.85 TOP1 (0.64) TOP1CYCSABCG2RAB9AALDH1A1
SCHEMBL29684671 0.85 TOP1 (0.64) TOP1CYCSABCG2RAB9AALDH1A1
SCHEMBL13609842 0.83 TOP1 (0.53) TOP1CYCSABCG2CYP2C19ENPP2
SCHEMBL16552331 0.82 TOP1 (0.71) TOP1CYCSABCG2MAPTSMN1; SMN2
SCHEMBL25395869 0.82 TOP1 (0.91) TOP1CYCSABCG2ALDH1A1KDM4E
SCHEMBL16418477 0.82 TOP1 (0.91) TOP1CYCSABCG2ALDH1A1KDM4E

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-2004092185-A1 LUMINESCENT LANTHANIDE (III) -CHELATED DENDRITIC COMPLEXES HAVING LIGHT-HARVESTING EFFECT AND THEIR SYNTHETIC METHODS KIM HWAN-KYU (KR) 2004-10-28 — — WO disclosed
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