Octadecanoic Acid Amide

Octadecanoic Acid Amide

SCHEMBL12478246

CCCCCCCCCCCCCCCCCC(N)=O.CCCCCCCCCCCCCCCCCC(N)=O.O=C(O)CCCCCC#CC#CCCCCCC(=O)O

nearest known ligand 0.86

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HMGCR P04035 6/20 0.86
▸ PTPN7 P35236 5/20 0.80
▸ TDP1 Q9NUW8 4/20 0.62
▸ RECQL P46063 2/20 0.62
▸ ALDH1A1 P00352 3/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ KDM4E B2RXH2 1/20 0.59
▸ USP2 O75604 1/20 0.59
▸ POLB P06746 1/20 0.59
▸ MAPT P10636 1/20 0.59
▸ HPGD P15428 1/20 0.59
▸ ALOX12 P18054 1/20 0.59
▸ BLM P54132 1/20 0.59
▸ MCL1 Q07820 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ PPARG P37231 5/20 0.59
▸ PPARD Q03181 5/20 0.59
▸ PPARA Q07869 5/20 0.59
▸ HDAC11 Q96DB2 4/20 0.59

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
SCHEMBL12477535 1.00 HMGCR (0.86) HMGCRPTPN7TDP1RECQLALDH1A1
Palmitamide SCHEMBL12477807 1.00 HMGCR (0.86) HMGCRPTPN7TDP1RECQLALDH1A1
Tetradecanamide SCHEMBL12477585 1.00 HMGCR (0.86) HMGCRPTPN7TDP1RECQLALDH1A1
SCHEMBL12477833 1.00 HMGCR (0.86) HMGCRPTPN7TDP1RECQLALDH1A1
Palmitamide SCHEMBL12477804 0.98 HMGCR (0.83) HMGCRPTPN7TDP1RECQLALDH1A1
Octadecanoic Acid Amide SCHEMBL12477855 0.97 PTPN7 (0.80) HMGCRPTPN7TDP1RECQLALDH1A1
SCHEMBL12478203 0.97 PTPN7 (0.80) HMGCRPTPN7TDP1RECQLALDH1A1
Tetradecanamide SCHEMBL12478352 0.97 PTPN7 (0.80) HMGCRPTPN7TDP1RECQLALDH1A1
SCHEMBL12477805 0.97 PTPN7 (0.80) HMGCRPTPN7TDP1RECQLALDH1A1
SCHEMBL413126 0.93 HMGCR (1.00) HMGCRPTPN7TDP1RECQLALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2678742-B1 REVERSIBLY ACTIVATABLE DIACETYLENES AND THEIR USE AS COLOUR-FORMERS DATALASE LTD (GB) 2018-08-29 — — EP claimed
US-20140127429-A1 REVERSIBLY ACTIVATABLE DIACETYLENES AND THEIR USE AS COLOUR-FORMERS DATALASE LTD. (UK) 2014-05-08 — — US claimed
WO-2012114121-A2 REVERSIBLY ACTIVATABLE DIACETYLENES AND THEIR USE AS COLOUR-FORMERS DATALASE LTD. (GB) 2012-08-30 — — WO claimed
EP-2678742-B1 REVERSIBLY ACTIVATABLE DIACETYLENES AND THEIR USE AS COLOUR-FORMERS DATALASE LTD (GB) 2018-08-29 — — EP disclosed
US-20140127429-A1 REVERSIBLY ACTIVATABLE DIACETYLENES AND THEIR USE AS COLOUR-FORMERS DATALASE LTD. (UK) 2014-05-08 — — US disclosed
WO-2012114121-A2 REVERSIBLY ACTIVATABLE DIACETYLENES AND THEIR USE AS COLOUR-FORMERS DATALASE LTD. (GB) 2012-08-30 — — WO disclosed
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