SCHEMBL6680920

SCHEMBL6680920

CCCCCCCCc1ccccc1CCCCCCC

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 1/20 0.69
▸ NR1H2 P55055 1/20 0.55
▸ NR1H3 Q13133 1/20 0.55
▸ KCNH2 Q12809 2/20 0.52
▸ BID P55957 3/20 0.52
▸ MCL1 Q07820 3/20 0.52
▸ BCL2L1 Q07817 2/20 0.52
▸ BAK1 Q16611 2/20 0.52
▸ KAT8 Q9H7Z6 2/20 0.52
▸ PPARG P37231 1/20 0.52
▸ PPARA Q07869 1/20 0.52
▸ EP300 Q09472 1/20 0.52
▸ KAT2A Q92830 1/20 0.52
▸ KAT2B Q92831 1/20 0.52
▸ KAT5 Q92993 1/20 0.52
▸ SAE1 Q9UBE0 1/20 0.52
▸ ALOX5 P09917 2/20 0.50
▸ THRA P10827 1/20 0.50
▸ THRB P10828 1/20 0.50
▸ PTGS2 P35354 1/20 0.50

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
SCHEMBL10980560 1.00 LIPG (0.69) LIPGNR1H2NR1H3KCNH2BID
SCHEMBL1412738 1.00 LIPG (0.69) LIPGNR1H2NR1H3KCNH2BID
SCHEMBL9699968 1.00 LIPG (0.69) LIPGNR1H2NR1H3KCNH2BID
SCHEMBL269513 1.00 LIPG (0.69) LIPGNR1H2NR1H3KCNH2BID
SCHEMBL7149646 1.00 LIPG (0.69) LIPGNR1H2NR1H3KCNH2BID
SCHEMBL3849327 1.00 LIPG (0.69) LIPGNR1H2NR1H3KCNH2BID
SCHEMBL7534048 1.00 LIPG (0.69) LIPGNR1H2NR1H3KCNH2BID
SCHEMBL10758354 1.00 LIPG (0.69) LIPGNR1H2NR1H3KCNH2BID
SCHEMBL271030 1.00 LIPG (0.69) LIPGNR1H2NR1H3KCNH2BID
SCHEMBL2511612 1.00 LIPG (0.69) LIPGNR1H2NR1H3KCNH2BID

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0985649-B1 Method for producing an aromatic compound having an alkyl group with at least three carbon atoms TORAY INDUSTRIES (JP) 2004-11-24 — — EP disclosed
US-6462248-B1 THROUGH CONVERSION, ISOMERIZATION AND/OR ADSORPTIVE SEPARATION OF AROMATIC COMPOUNDS TORAY INDUSTRIES, INC. (JP) 2002-10-08 — — US disclosed
EP-0985649-A2 Method for producing an aromatic compound having an alkyl group with at least three carbon atoms TORAY INDUSTRIES, INC. (JP) 2000-03-15 — — EP disclosed
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