SCHEMBL23857352

SCHEMBL23857352

O=C(O)C1(C(=O)O)Cc2cc(=O)n(Cc3ccccc3)cc2C1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SNRNP200 O75643 4/20 0.43
BRD4 O60885 2/20 0.43
BRD2 P25440 1/20 0.43
BRD3 Q15059 1/20 0.43
BRDT Q58F21 1/20 0.43
MAPK14 Q16539 1/20 0.39
MAP4K1 Q92918 1/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.38
PKM P14618 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
ADRA1D P25100 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL28908654 0.89 BRD4 (0.43) SNRNP200BRD4BRD2BRD3BRDT
SCHEMBL23856760 0.86 BRD4 (0.44) SNRNP200BRD4BRD2BRD3BRDT
SCHEMBL13734925 0.70 ALDH1A1 (0.44) SNRNP200BRD4BRD2BRD3BRDT
SCHEMBL8882974 0.69 KMT2A (0.46) BRD4ALDH1A1GAA
SCHEMBL1640352 0.68 LMNA (0.55) BRD4BRD2BRD3BRDTALDH1A1
SCHEMBL13734781 0.68 HTR2C (0.51) SNRNP200MAPK14MAP4K1ALDH1A1LMNA
SCHEMBL10017252 0.67 MAPK14 (0.51) SNRNP200BRD4BRD2BRD3BRDT
SCHEMBL1014144 0.67 MMP8 (0.47) ALDH1A1
SCHEMBL30863938 0.67 MMP8 (0.47) ALDH1A1
Hydrochloric Acid SCHEMBL30701473 0.67 HTR2C (0.50) SNRNP200MAPK14MAP4K1ALDH1A1LMNA

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
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
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 SNRNP200 4493/4885BRD4 355/4885BRD2 1736/4885

“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.