SCHEMBL17509786

SCHEMBL17509786

CCCCCCCCCC(CCCCC)CCCCc1c(O)cccc1OCC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 7/20 0.51
▸ CNR2 P34972 7/20 0.51
▸ ALOX5 P09917 2/20 0.40
▸ PTGS2 P35354 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ BID P55957 3/20 0.39
▸ MCL1 Q07820 3/20 0.39
▸ BCL2L1 Q07817 2/20 0.39
▸ BAK1 Q16611 2/20 0.39
▸ KAT8 Q9H7Z6 2/20 0.39
▸ PPARG P37231 1/20 0.39
▸ PPARA Q07869 1/20 0.39
▸ EP300 Q09472 1/20 0.39
▸ KAT2A Q92830 1/20 0.39
▸ KAT2B Q92831 1/20 0.39
▸ KAT5 Q92993 1/20 0.39
▸ SAE1 Q9UBE0 1/20 0.39

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
SCHEMBL27830010 0.92 CNR1 (0.57) CNR1CNR2ALOX5PTGS2BID
SCHEMBL29508273 0.92 CNR1 (0.57) CNR1CNR2ALOX5PTGS2BID
SCHEMBL677347 0.92 CNR1 (0.57) CNR1CNR2ALOX5PTGS2BID
SCHEMBL10426325 0.92 CNR1 (0.57) CNR1CNR2ALOX5PTGS2BID
SCHEMBL8757422 0.92 CNR1 (0.57) CNR1CNR2ALOX5PTGS2BID
SCHEMBL17509802 0.88 ALOX5 (0.51) CNR1CNR2ALOX5PTGS2KDM4E
SCHEMBL4932162 0.86 CNR1 (0.45) CNR1CNR2ALOX5KDM4EMEN1
SCHEMBL25382247 0.85 CNR1 (0.50) CNR1CNR2ALOX5PTGS2KDM4E
SCHEMBL17509780 0.85 BID (0.46) MEN1KMT2ABIDMCL1BCL2L1
Sulfuric Acid SCHEMBL27552496 0.84 CNR1 (0.54) CNR1CNR2ALOX5PTGS2KDM4E

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-20160083513-A1 POLYCARBONATE RESIN FOR LIQUID CRYSTAL MEMBERS, POLYCARBONATE RESIN COMPOSITION FOR LIQUID CRYSTAL MEMBERS WHICH CONTAINS SAME, AND LIQUID CRYSTAL MEMBER IDEMITSU KOSAN CO., LTD. (JP) 2016-03-24 — — US disclosed
EP-2987816-A1 POLYCARBONATE RESIN FOR LIQUID CRYSTAL MEMBERS, POLYCARBONATE RESIN COMPOSITION FOR LIQUID CRYSTAL MEMBERS WHICH CONTAINS SAME, AND LIQUID CRYSTAL MEMBER Idemitsu Kosan Co., Ltd (JP) 2016-02-24 — — EP disclosed
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