SCHEMBL24855261

SCHEMBL24855261

O=c1n(CCCCC2CO2)c(=O)n(CCCC2CO2)c(=O)n1CCCC1CO1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.50
HBB P68871 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 2/20 0.31
DHFR P00374 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
SCHEMBL8577891 0.98 TP53 (0.52) TP53HBBSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL17153973 0.96 TP53 (0.47) TP53HBBSMN1; SMN2ALDH1A1
SCHEMBL10329459 0.96 TP53 (0.50) TP53HBBSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL20495997 0.96 TP53 (0.50) TP53HBBSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL20495995 0.96 TP53 (0.50) TP53HBBSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL21991221 0.96 TP53 (0.54) TP53HBBSMN1; SMN2ALDH1A1DHFR
SCHEMBL8580238 0.96 TP53 (0.54) TP53HBBSMN1; SMN2ALDH1A1DHFR
SCHEMBL21026336 0.96 TP53 (0.54) TP53HBBSMN1; SMN2ALDH1A1DHFR
SCHEMBL17153972 0.92 TP53 (0.50) TP53HBBSMN1; SMN2ALDH1A1DHFR
SCHEMBL12047489 0.90 TP53 (0.45) TP53HBBSMN1; SMN2ALDH1A1CYP1A2

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
WO-2023276517-A1 RESIN COMPOSITION, CURED PRODUCT, PRODUCTION METHOD FOR CURED PRODUCT, ELECTRONIC COMPONENT, DISPLAY DEVICE, AND SEMICONDUCTOR DEVICE 東レ株式会社 2023-01-05 WO disclosed