SCHEMBL30388404

SCHEMBL30388404

CCO[Si](CC)(CCN1CCOCC1)OCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
MAPK1 P28482 2/20 0.38
CYP1A2 P05177 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
HTR2A P28223 1/20 0.38
SCN1A P35498 1/20 0.38
HTR2B P41595 1/20 0.38
KCNH2 Q12809 1/20 0.38
SCN2A Q99250 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
SCN3A Q9NY46 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
TSHR P16473 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL612462 0.90 SMN1; SMN2 (0.47) ALDH1A1MAPK1CYP1A2CHRM2CHRM1
SCHEMBL612357 0.75 SMN1; SMN2 (0.46) ALDH1A1MAPK1CYP1A2CHRM2CHRM1
SCHEMBL2797041 0.75 SMN1; SMN2 (0.46) ALDH1A1MAPK1CYP1A2CHRM2CHRM1
SCHEMBL612716 0.75 SMN1; SMN2 (0.46) ALDH1A1MAPK1CYP1A2CHRM2CHRM1
SCHEMBL614018 0.74 SMN1; SMN2 (0.48) ALDH1A1MAPK1CYP1A2CHRM2CHRM1
SCHEMBL28862350 0.74 ALDH1A1 (0.44) ALDH1A1MAPK1CYP1A2CHRM2CHRM1
SCHEMBL29288458 0.72 ALDH1A1 (0.43) ALDH1A1MAPK1CYP1A2CHRM2CHRM1
SCHEMBL9516216 0.72 ALDH1A1 (0.43) ALDH1A1MAPK1CYP1A2CHRM2CHRM1
SCHEMBL497398 0.71 PAOX (0.36) ALDH1A1SIGMAR1HRH3USP2HPGD
SCHEMBL614544 0.71 HRH3 (0.43) ALDH1A1MAPK1CYP1A2HRH3TSHR

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-4172246-A1 MOISTURE-CURING CONFORMAL COATING COMPOSITIONS Wacker Chemie AG (DE) 2023-05-03 EP disclosed