SCHEMBL11697387

SCHEMBL11697387

CC(O)(CCCCCCO)C(O)CCCCCCO

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.38
ACACA Q13085 1/20 0.38
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL11693688 0.98 ACACB (0.35) ACACBACACACYP4F2CYP4A11LMNA
SCHEMBL16078698 0.90 LMNA (0.50) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL16078640 0.90 LMNA (0.50) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL16078700 0.90 LMNA (0.50) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL16078690 0.90 LMNA (0.50) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL16078627 0.90 LMNA (0.50) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL8512233 0.89 SMN1; SMN2 (0.31)
SCHEMBL16078688 0.85 SMN1; SMN2 (0.44) CYP4F2CYP4A11LMNAALDH1A1HSD17B10
SCHEMBL5141338 0.84
SCHEMBL29092835 0.84 PTGS1 (0.32)

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-4057589-A Hydroxylation of unsaturated diols to prepare novel tetraols CHEVRON RESEARCH COMPANY (US) 1977-11-08 US disclosed
US-3991126-A CHEMICAL INTERMEDIATES AND HUMECTANTS CHEVRON RESEARCH COMPANY (US) 1976-11-09 US disclosed