SCHEMBL21095372

SCHEMBL21095372

OC1O[C@H](CI)C[C@H](O)[C@H]1O

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.32
CHRM1 P11229 2/20 0.32
CHRM3 P20309 2/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL21095322 0.84 CHRM5 (0.31) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL22045699 0.79 TSHR (0.33) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL6933813 0.79 TSHR (0.33) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL6932362 0.79 TSHR (0.33) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL24943522 0.79 TSHR (0.33) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL24520605 0.79 TSHR (0.33) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL21370154 0.79 TSHR (0.33) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL12522349 0.79 TSHR (0.33) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL18850030 0.79 TSHR (0.33) CHRM5CHRM1CHRM3CHRM2CHRM4
SCHEMBL13446420 0.79 TSHR (0.33) CHRM5CHRM1CHRM3CHRM2CHRM4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019115614-A1 PEPTIDIC MELANOCORTIN 1 RECEPTOR AGONIST - SACCHARIDE FUNCTIONALISED CARBABORANE CONJUGATES UNIVERSITÄT LEIPZIG (DE) 2019-06-20 WO disclosed
WO-2019115611-A1 PEPTIDIC BB2 RECEPTOR AGONIST – SACCHARIDE FUNCTIONALISED CARBABORANE CONJUGATES UNIVERSITÄT LEIPZIG (DE) 2019-06-20 WO disclosed
WO-2019115609-A1 SACCHARIDE FUNCTIONALISED CARBABORANE CONJUGATES OF HUMAN PEPTIDE Y UNIVERSITÄT LEIPZIG (DE) 2019-06-20 WO disclosed