SCHEMBL8945767

SCHEMBL8945767

CC=C(CCCCCCCCCCCCCC)OCCCCCCCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.47
DGKA P23743 1/20 0.47
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA9 Q16790 2/20 0.45
HCAR2 Q8TDS4 1/20 0.44
EPHX1 P07099 1/20 0.44
GPR84 Q9NQS5 7/20 0.43
PPARG P37231 6/20 0.43
PPARD Q03181 6/20 0.43
PPARA Q07869 6/20 0.43
HDAC11 Q96DB2 5/20 0.43
TSHR P16473 4/20 0.43
ALDH1A1 P00352 2/20 0.43
TLR2 O60603 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
FABP4 P15090 2/20 0.43
PTPN1 P18031 2/20 0.43
SLC22A6 Q4U2R8 1/20 0.43

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
SCHEMBL28311277 0.90 LMNA (0.44) NAAACA12CA1CA2CA9
SCHEMBL5821498 0.86 DGKA (0.47) DGKAGPR84PPARGPPARDPPARA
SCHEMBL5439476 0.85 TSHR (0.50) NAAACA12CA1CA2CA9
SCHEMBL8069698 0.84 FAAH (0.46) DGKAGPR84PPARGPPARDPPARA
SCHEMBL27540314 0.84 NAAA (0.48) NAAACA12CA1CA2CA9
SCHEMBL5431314 0.83 TSHR (0.47) NAAACA12CA1CA2CA9
SCHEMBL9019586 0.79 CES2 (0.44) DGKAGPR84PPARGPPARDPPARA
SCHEMBL4645612 0.79 CES2 (0.44) DGKAGPR84PPARGPPARDPPARA
SCHEMBL845324 0.79 CES2 (0.44) DGKAGPR84PPARGPPARDPPARA
SCHEMBL845323 0.79 CES2 (0.44) DGKAGPR84PPARGPPARDPPARA

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
US-5529768-A HAVING NONIONIC AND ANIONIC SURFACTANT CHARACTERISTICS LEVER BROTHERS COMPANY (US) 1996-06-25 US disclosed
US-5505938-A HAVING BOTH ANIONIC AND NONIONIC SURFACTANT CHARACTERISTICS; BIODEGRADABLE LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1996-04-09 US disclosed