SCHEMBL23856735

SCHEMBL23856735

C[Si](C)(C)CCOCN1C(=O)COc2ccc(Br)nc21

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.37
BRD4 O60885 3/20 0.36
KDM4E B2RXH2 1/20 0.35
TSHR P16473 2/20 0.34
REN P00797 1/20 0.33
HTT P42858 3/20 0.33
POLB P06746 1/20 0.33
HSD17B10 Q99714 1/20 0.33
USP2 O75604 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
THRB P10828 1/20 0.32
PLK1 P53350 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL30046705 1.00 DGAT1 (0.37) DGAT1BRD4KDM4ETSHRREN
SCHEMBL25569993 0.86 BRD4 (0.35) BRD4KDM4ETSHRRENHTT
SCHEMBL2396222 0.81 USP19 (0.38) BRD4KDM4ETSHRPOLBHSD17B10
SCHEMBL23857189 0.81 TSHR (0.38) BRD4KDM4ETSHRHTTPOLB
SCHEMBL23856789 0.80 DGAT1 (0.39) DGAT1
SCHEMBL23856967 0.79 BRD4 (0.45) BRD4KDM4ETSHRRENHTT
SCHEMBL30047345 0.79 BRD4 (0.45) BRD4KDM4ETSHRRENHTT
SCHEMBL30047633 0.78 BRD4 (0.33) BRD4KDM4EREN
SCHEMBL23857153 0.78 BRD4 (0.33) BRD4KDM4EREN
SCHEMBL23856871 0.78 BRD4 (0.33) BRD4KDM4EREN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4126855-B1 COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTIONS HOFFMANN LA ROCHE (CH) 2024-04-24 EP disclosed
US-20230167127-A1 COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTION HOFFMANN-LA ROCHE INC. (US) 2023-06-01 US disclosed
US-20230167127-A1 COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTION HOFFMANN-LA ROCHE INC. (US) 2023-06-01 US disclosed
US-20230167127-A1 COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTION HOFFMANN-LA ROCHE INC. (US) 2023-06-01 US disclosed
EP-4126855-A1 COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTION F. Hoffmann-La Roche AG (CH) 2023-02-08 EP disclosed
WO-2021190727-A1 COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTION F. HOFFMANN-LA ROCHE AG (CH) 2021-09-30 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-20230167127-A1 COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTION LTB4R, C5, C3AR1 DGAT1 3509/4885BRD4 355/4885KDM4E 4195/4885

“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.