SCHEMBL11237451

SCHEMBL11237451

CCCCCCCCCCCCCCCCC=CS(=O)(=O)OCC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.45
TRPV1 Q8NER1 1/20 0.45
PPARA Q07869 2/20 0.43
LPAR3 Q9UBY5 1/20 0.41
GMNN O75496 1/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
CYP2C9 P11712 1/20 0.40
ALOX15 P16050 1/20 0.40
APEX1 P27695 1/20 0.40
CYP2C19 P33261 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
DUSP3 P51452 1/20 0.40
MMP2 P08253 1/20 0.40

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
SCHEMBL10000838 1.00 FAAH (0.45) FAAHTRPV1PPARALPAR3GMNN
SCHEMBL10000839 0.98 FAAH (0.42) FAAHTRPV1PPARALPAR3
SCHEMBL10000859 0.92 PTPN1 (0.40) FAAHTRPV1PPARALPAR3LMNA
SCHEMBL11742320 0.90 PTPN1 (0.39) FAAHTRPV1PPARALPAR3
SCHEMBL10000861 0.84 PTPN1 (0.42)
SCHEMBL6387906 0.82 FAAH (0.47) FAAHTRPV1PPARAGMNNUSP2
SCHEMBL8760961 0.82 FAAH (0.47) FAAHTRPV1PPARAGMNNUSP2
SCHEMBL10000840 0.82 FAAH (0.47) FAAHTRPV1PPARAGMNNUSP2
SCHEMBL10000847 0.82 TSHR (0.44) FAAHTRPV1PPARAGMNNUSP2
SCHEMBL29727693 0.82 FAAH (0.44) FAAHTRPV1PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4310471-A SURFACTANTS EXXON RESEARCH & ENGINEERING CO. (US) 1982-01-12 US disclosed