SCHEMBL10705706

SCHEMBL10705706

CCCCCC(N)N(CCCCCCO)CCCCCCO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.48
ALDH1A1 P00352 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TSHR P16473 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.44
SPHK1 Q9NYA1 3/20 0.43
CYP2D6 P10635 2/20 0.43
TP53 P04637 2/20 0.43
PLA2G1B P04054 1/20 0.43
PLA2G2A P14555 1/20 0.43
GMNN O75496 1/20 0.43
POLB P06746 1/20 0.43
THPO P40225 1/20 0.43
MTOR P42345 1/20 0.43
BLM P54132 1/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 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
SCHEMBL6908178 0.90 PLA2G1B (0.50) LMNASPHK1CYP2D6TP53PLA2G1B
SCHEMBL15477624 0.90 PLA2G1B (0.50) LMNASPHK1CYP2D6TP53PLA2G1B
SCHEMBL9766793 0.86 PLA2G1B (0.50) LMNASPHK1CYP2D6TP53PLA2G1B
SCHEMBL9244931 0.86 PLA2G1B (0.50) LMNASPHK1CYP2D6TP53PLA2G1B
SCHEMBL10879073 0.84 OPRM1 (0.48) LMNASPHK1CYP2D6TP53PLA2G1B
Fluoride SCHEMBL30801645 0.84 LMNA (0.42) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL27528570 0.80 ALDH1A1 (0.37) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL7532621 0.80 LMNA (0.39) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL7189754 0.80 OPRM1 (0.48) LMNASPHK1CYP2D6TP53PLA2G1B
Bromide SCHEMBL14778430 0.79 LMNA (0.50) LMNAALDH1A1HSD17B10MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0178960-B1 DIESEL FUEL COMPOSITIONS ETHYL PETROLEUM ADDITIVES, INC. (US) 1988-10-12 EP disclosed
EP-0178960-A1 Diesel fuel compositions ETHYL PETROLEUM ADDITIVES, INC. (US) 1986-04-23 EP disclosed
US-4553979-A ORGANIC NITRATE, ALKYLPHENOL-AMINE CONDENSATE ETHYL PETROLEUM ADDITIVES, INC. (US) 1985-11-19 US disclosed
US-4398921-A DETERGENT, ALKYLPHENOL-ALDEHYDE-AMINE REACTION PRODUCT, DEMULSIFIER, POLYETHER, OXYALKYLATED PHENOL-FORMALDEHYDE RESIN ETHYL CORPORATION (US) 1983-08-16 US disclosed
US-4322220-A Multipurpose hydrocarbon fuel and lubricating oil additive ROHM AND HAAS COMPANY (US) 1982-03-30 US disclosed
US-4311562-A Method for inhibiting deposit formation in process equipment associated with separation and purification of alkyl phosphorochloridothioates ETHYL CORPORATION (US) 1982-01-19 US disclosed
US-4259086-A DETERGENTS, CORROSION PREVENTION ROHM AND HAAS COMPANY (US) 1981-03-31 US disclosed
US-4147641-A SUBSTITUTED PHENOL-EPICHLOROHYDRIN-AMINE ADDUCT AND A POLYCARBOXYLIC ACID ESTER ROHM AND HAAS COMPANY (US) 1979-04-03 US disclosed
US-4134846-A ADDUCT OF ALKYLPHENYL GLYCIDYL ETHER AND AMINE, POLYALKYLENE PHENOL ROHM AND HAAS COMPANY (US) 1979-01-16 US disclosed
US-4116644-A CARBURETOR DETERGENT JACKISCH PHILIP F 1978-09-26 US disclosed
US-3994698-A REACTION PRODUCT OF AN ALKYLPHENOL WITH AN ALDEHYDE AND AN AMINE ETHYL CORPORATION (US) 1976-11-30 US disclosed
US-3948619-A REACTION PRODUCT OF AN ALKYLPHENOL, AN ALDEHYDE AND AN AMINE; POLYOLEFIN ETHYL CORPORATION (US) 1976-04-06 US disclosed