SCHEMBL1273280

SCHEMBL1273280

CCCCCCC#CC#CCCCCCC(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HMGCR P04035 4/20 1.00
▸ PTPN7 P35236 4/20 0.92
▸ TDP1 Q9NUW8 3/20 0.70
▸ RECQL P46063 1/20 0.70
▸ GPR84 Q9NQS5 6/20 0.68
▸ PPARG P37231 6/20 0.68
▸ PPARD Q03181 6/20 0.68
▸ PPARA Q07869 6/20 0.68
▸ HDAC11 Q96DB2 5/20 0.68
▸ TSHR P16473 4/20 0.68
▸ ALDH1A1 P00352 2/20 0.68
▸ TLR2 O60603 2/20 0.68
▸ FABP4 P15090 2/20 0.68
▸ PTPN1 P18031 2/20 0.68
▸ SLC22A6 Q4U2R8 1/20 0.68
▸ SLC22A8 Q8TCC7 1/20 0.68
▸ MEN1 O00255 1/20 0.68
▸ ESR1 P03372 1/20 0.68
▸ ALOX15 P16050 1/20 0.68
▸ PDE4A P27815 1/20 0.68

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
SCHEMBL1540420 1.00 HMGCR (1.00) HMGCRPTPN7TDP1RECQLGPR84
SCHEMBL13591745 1.00 HMGCR (1.00) HMGCRPTPN7TDP1RECQLGPR84
SCHEMBL416620 1.00 HMGCR (1.00) HMGCRPTPN7TDP1RECQLGPR84
SCHEMBL4233626 1.00 HMGCR (1.00) HMGCRPTPN7TDP1RECQLGPR84
SCHEMBL3666452 1.00 HMGCR (1.00) HMGCRPTPN7TDP1RECQLGPR84
SCHEMBL15463024 1.00 HMGCR (1.00) HMGCRPTPN7TDP1RECQLGPR84
SCHEMBL3673414 1.00 HMGCR (1.00) HMGCRPTPN7TDP1RECQLGPR84
SCHEMBL3666367 1.00 HMGCR (1.00) HMGCRPTPN7TDP1RECQLGPR84
SCHEMBL413126 1.00 HMGCR (1.00) HMGCRPTPN7TDP1RECQLGPR84
SCHEMBL13748701 1.00 HMGCR (1.00) HMGCRPTPN7TDP1RECQLGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110126325-A1 RECOMBINANT CELLS AND METHODS FOR HYDROXYLATING FATTY ACIDS COMMONWEALTH SCIENTIFIC INDUSTRIAL RESEARCH ORGANISATION 2011-05-26 — — US disclosed
US-20110126325-A1 RECOMBINANT CELLS AND METHODS FOR HYDROXYLATING FATTY ACIDS COMMONWEALTH SCIENTIFIC INDUSTRIAL RESEARCH ORGANISATION 2011-05-26 — — US disclosed
EP-2283137-A1 RECOMBINANT CELLS AND METHODS FOR HYDROXYLATING FATTY ACIDS Commonwealth Scientific and Industrial Research Organisation (AU) 2011-02-16 — — EP disclosed
WO-2009129583-A1 RECOMBINANT CELLS AND METHODS FOR HYDROXYLATING FATTY ACIDS COMMONWEALTH SCIENTIFIC INDUSTRIAL RESEARCH ORGANISATION (AU) 2009-10-29 — — WO disclosed
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