SCHEMBL10906302

SCHEMBL10906302

CCC=C(O)OC(=O)C1CCCCC1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PEPD P12955 1/20 0.36
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL598373 0.78 PEPD (0.43) PEPDTP53CYP3A4
SCHEMBL34169 0.78 PEPD (0.43) PEPDTP53CYP3A4
SCHEMBL130870 0.78 PEPD (0.43) PEPDTP53CYP3A4
SCHEMBL10578737 0.78 PEPD (0.43) PEPDTP53CYP3A4
SCHEMBL7031195 0.76 PEPD (0.42) PEPDTP53CYP3A4
SCHEMBL9663237 0.76 PEPD (0.42) PEPDTP53CYP3A4
SCHEMBL11660179 0.76 PEPD (0.42) PEPDTP53CYP3A4
SCHEMBL10739888 0.76 PEPD (0.42) PEPDTP53CYP3A4
Bicarbonate SCHEMBL8981886 0.76 ALDH1A1 (0.46) PEPDTP53CYP3A4
SCHEMBL2487826 0.75 PEPD (0.40) PEPD

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-4581420-A RESILENT, HIGH MOLECULAR WEIGHT MOLDING MATERIALS GENERAL ELECTRIC COMPANY (US) 1986-04-08 US disclosed