SCHEMBL21551898

SCHEMBL21551898

CCCCCCCCCCC=CO[Si](C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.45
TRPV1 Q8NER1 1/20 0.45
TERT O14746 3/20 0.39
PTPN1 P18031 3/20 0.39
CYP1A2 P05177 2/20 0.39
MAPT P10636 2/20 0.39
CYP2C19 P33261 2/20 0.39
BLM P54132 2/20 0.39
HSD17B10 Q99714 2/20 0.39
FABP4 P15090 2/20 0.39
PPARG P37231 2/20 0.39
KMT2A Q03164 2/20 0.39
PPARD Q03181 2/20 0.39
PPARA Q07869 2/20 0.39
GMNN O75496 1/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX15 P16050 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
SCHEMBL18092326 1.00 FAAH (0.45) FAAHTRPV1TERTPTPN1CYP1A2
SCHEMBL18092325 1.00 FAAH (0.45) FAAHTRPV1TERTPTPN1CYP1A2
SCHEMBL10615531 0.91 TSHR (0.35) FAAHTRPV1F7F3
SCHEMBL10615526 0.91 TSHR (0.35) FAAHTRPV1F7F3
SCHEMBL18092328 0.80 FAAH (0.39) FAAHTRPV1TERTPTPN1CYP1A2
SCHEMBL17017289 0.80 FAAH (0.39) FAAHTRPV1TERTPTPN1CYP1A2
SCHEMBL31028389 0.79 LPAR2 (0.30)
SCHEMBL5679512 0.77 TSHR (0.42) FAAHTRPV1CYP1A2MAPTCYP2C19
SCHEMBL23673186 0.77 FAAH (0.52) FAAHTRPV1TERTPTPN1CYP1A2
SCHEMBL9785179 0.77 FAAH (0.52) FAAHTRPV1TERTPTPN1CYP1A2

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-3810778-A1 MULTIFUNCTIONAL FATTY ACID DERIVATIVES AND BIOSYNTHESIS THEREOF Genomatica, Inc. (US) 2021-04-28 EP disclosed
WO-2019217226-A1 MULTIFUNCTIONAL FATTY ACID DERIVATIVES AND BIOSYNTHESIS THEREOF REG Life Sciences, LLC (US) 2019-11-14 WO disclosed