SCHEMBL20476451

SCHEMBL20476451

CCCCCc1ccc(-c2cc3ccc(OCCCCCC[Si](C)(OCC)OCC)cc3oc2=O)c(C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.44
MAOA P21397 4/20 0.44
KDM4E B2RXH2 3/20 0.42
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 2/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
PKM P14618 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA6 P23280 2/20 0.39
CA7 P43166 2/20 0.39

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
SCHEMBL23542239 1.00 MAOB (0.44) MAOBMAOAKDM4EHPGDSMN1; SMN2
SCHEMBL23542221 1.00 MAOB (0.44) MAOBMAOAKDM4EHPGDSMN1; SMN2
SCHEMBL23542264 0.94 MAOB (0.44) MAOBMAOAKDM4EHPGDSMN1; SMN2
SCHEMBL23542203 0.94 MAOB (0.44) MAOBMAOAKDM4EHPGDSMN1; SMN2
SCHEMBL23542215 0.93 KDM4E (0.40) MAOBMAOAKDM4EHPGDSMN1; SMN2
SCHEMBL23542255 0.92 MAOB (0.43) MAOBMAOAKDM4EHPGDSMN1; SMN2
SCHEMBL23542214 0.90 KDM4E (0.39) MAOBMAOAKDM4EHPGDSMN1; SMN2
SCHEMBL23316728 0.90 KDM4E (0.39) MAOBMAOAKDM4EHPGDSMN1; SMN2
SCHEMBL23542250 0.89 MAOB (0.43) MAOBMAOAKDM4EHPGDSMN1; SMN2
SCHEMBL23542240 0.89 MAOB (0.43) MAOBMAOAKDM4EHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11040990-B2 Compounds containing Si atoms for optically active devices MERCK PATENT GMBH (DE) 2021-06-22 US disclosed
US-11040990-B2 Compounds containing Si atoms for optically active devices MERCK PATENT GMBH (DE) 2021-06-22 US disclosed
EP-3583100-B1 COMPOUNDS CONTAINING SI ATOMS FOR OPTICALLY ACTIVE DEVICES MERCK PATENT GMBH (DE) 2021-05-05 EP disclosed
WO-2018149857-A1 COMPOUNDS CONTAINING SI ATOMS FOR OPTICALLY ACTIVE DEVICES MERCK PATENT GMBH (DE) 2018-08-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11040990-B2 Compounds containing Si atoms for optically active devices UACA, EYA3, PDE6C MAOB 2426/4885MAOA 2003/4885KDM4E 4303/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.