SCHEMBL16103147

SCHEMBL16103147

C=C/C=C/C/C=C/CC/C=C/C.C=CCCC/C=C/CC/C=C/C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 3/20 0.33
OXER1 Q8TDS5 3/20 0.33
TRPV1 Q8NER1 1/20 0.32
ALDH1A1 P00352 3/20 0.32
TSHR P16473 2/20 0.32
CNR1 P21554 1/20 0.32
ALOX15 P16050 2/20 0.31
PPARG P37231 4/20 0.31
PPARD Q03181 3/20 0.31
PPARA Q07869 3/20 0.31
F7 P08709 2/20 0.31
CYP19A1 P11511 2/20 0.31
F3 P13726 2/20 0.31
PTGS1 P23219 2/20 0.31
KMT2A Q03164 2/20 0.31
ADORA3 P0DMS8 1/20 0.31
RXRA P19793 1/20 0.31
ALOX5 P09917 1/20 0.31
FFAR1 O14842 2/20 0.30
L3MBTL1 Q9Y468 2/20 0.30

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
SCHEMBL16103148 1.00 ALOX12 (0.33) ALOX12OXER1TRPV1ALDH1A1TSHR
SCHEMBL6202636 0.89 ALDH1A1 (0.38) OXER1ALDH1A1TSHRALOX15PPARG
SCHEMBL6202638 0.89 ALDH1A1 (0.38) OXER1ALDH1A1TSHRALOX15PPARG
SCHEMBL6202322 0.88 TSHR (0.35) ALOX12OXER1TRPV1ALDH1A1TSHR
SCHEMBL6202318 0.88 TSHR (0.35) ALOX12OXER1TRPV1ALDH1A1TSHR
SCHEMBL4929461 0.88 PPARA (0.31) OXER1ALDH1A1PPARGPPARACYP19A1
SCHEMBL4929453 0.88 PPARA (0.31) OXER1ALDH1A1PPARGPPARACYP19A1
SCHEMBL6199757 0.88 PPARA (0.31) OXER1ALDH1A1PPARGPPARACYP19A1
SCHEMBL6199761 0.88 PPARA (0.31) OXER1ALDH1A1PPARGPPARACYP19A1
SCHEMBL10887563 0.84 ALDH1A1 (0.40) OXER1TRPV1ALDH1A1TSHRCNR1

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
EP-2969020-A1 SPECIFIC UNSATURATED AND BRANCHED FUNCTIONAL MATERIALS FOR USE IN CONSUMER PRODUCTS The Procter & Gamble Company (US) 2016-01-20 EP disclosed
WO-2014150171-A1 SPECIFIC UNSATURATED AND BRANCHED FUNCTIONAL MATERIALS FOR USE IN CONSUMER PRODUCTS THE PROCTER & GAMBLE COMPANY (US) 2014-09-25 WO disclosed