SCHEMBL7735624

SCHEMBL7735624

CCCCC1(CC)CCOC(=O)O1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.38
LMNA P02545 1/20 0.31
CYP2C9 P11712 1/20 0.31
HSD17B10 Q99714 1/20 0.30
CYP1A2 P05177 1/20 0.30

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
SCHEMBL3409800 0.85 LMNA (0.32) LMNACYP2C9
SCHEMBL18036580 0.79 PRKCD (0.37) SIRT2LMNACYP2C9
SCHEMBL3101853 0.75 SIRT2 (0.54) SIRT2HSD17B10CYP1A2
SCHEMBL8168979 0.71
SCHEMBL28467159 0.71
SCHEMBL1070967 0.69
SCHEMBL5538635 0.68 LMNA (0.35) LMNACYP2C9
SCHEMBL9799306 0.68
SCHEMBL12637696 0.68 LMNA (0.32) SIRT2LMNACYP2C9HSD17B10CYP1A2
SCHEMBL28491010 0.67 LMNA (0.34) SIRT2LMNACYP2C9HSD17B10CYP1A2

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-6479593-B2 CROSS-LINKED SUPER ABSORBING POLYMERS MADE BY REACTING A COPOLYMER HAVING AN ESTERIFIABLE ACID GROUP WITH A CYCLIC ALKYLENE CARBONATE; DIAPERS, DISPOSABLE PRODUCTS HUNTSMAN PETROCHEMICAL CORPORATION 2002-11-12 US disclosed