SCHEMBL25568301

SCHEMBL25568301

CC(C)(C)[Si](OCC[C@]1(N)C[C@H](C)C1)(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SMYD2 Q9NRG4 3/20 0.40
KDM1A O60341 8/20 0.34
MAOA P21397 8/20 0.34
MAOB P27338 8/20 0.34

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
SCHEMBL25568303 1.00 CYP3A4 (0.42) CYP3A4HTTSMN1; SMN2SMYD2KDM1A
SCHEMBL25568302 0.89 CYP3A4 (0.42) CYP3A4HTTSMN1; SMN2SMYD2KDM1A
SCHEMBL25568304 0.89 CYP3A4 (0.42) CYP3A4HTTSMN1; SMN2SMYD2KDM1A
SCHEMBL31251918 0.77 SMN1; SMN2 (0.43) CYP3A4HTTSMN1; SMN2SMYD2KDM1A
SCHEMBL31252128 0.75 CYP3A4 (0.43) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL29239690 0.74 MAOA (0.38) CYP3A4HTTSMN1; SMN2SMYD2KDM1A
SCHEMBL13103206 0.73 SMYD2 (0.40) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL453430 0.73 SMN1; SMN2 (0.44) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL15348146 0.72 CYP3A4 (0.54) CYP3A4HTTSMN1; SMN2SMYD2MAOB
SCHEMBL10422986 0.71 SMYD2 (0.35) CYP3A4HTTSMN1; SMN2SMYD2KDM1A

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
US-20230159517-A1 CHROMANE AMIDINE MONOBACTAM COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS MERCK SHARP & DOHME LLC (US) 2023-05-25 US 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-20230159517-A1 CHROMANE AMIDINE MONOBACTAM COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS TCOF1, SLC10A2, PAM CYP3A4 3234/4885HTT 3703/4885SMN1; SMN2 1717/4885

“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.