SCHEMBL29742575

SCHEMBL29742575

C1COC([C@@H]2COCCO2)CO1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM3 P20309 1/20 0.37
TTR P02766 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
SCHEMBL573582 1.00 CHRM2 (0.37) CHRM2CHRM4CHRM5CHRM3TTR
Hydrochloric Acid SCHEMBL25245581 0.97 CHRM2 (0.36) CHRM2CHRM4CHRM5CHRM3TTR
SCHEMBL29023882 0.97
SCHEMBL28436926 0.97 TTR (0.40) CHRM2CHRM4CHRM5CHRM3TTR
SCHEMBL16878490 0.94
SCHEMBL18885585 0.91 CHRM2 (0.33) CHRM2CHRM4CHRM5CHRM3
SCHEMBL7274558 0.89
SCHEMBL16878223 0.88 CHRM2 (0.32) CHRM2CHRM4CHRM5CHRM3
SCHEMBL7268795 0.84
SCHEMBL15824288 0.84 CHRM2 (0.33) CHRM2CHRM4CHRM5CHRM3

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
EP-4019519-A1 NOVEL DIHYDROPYRIMIDINOISOQUINOLINONES AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF INFLAMMATORY DISORDERS Galapagos N.V. (BE) 2022-06-29 EP disclosed