SCHEMBL9720476

SCHEMBL9720476

O=C(Cl)c1c(F)c(F)c(Br)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
ALDH1A1 P00352 2/20 0.32
ALOX15 P16050 1/20 0.30

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
SCHEMBL9135317 0.87 CES2 (0.39) CES2CES1ALDH1A1
SCHEMBL996758 0.86 CES2 (0.43) CES2CES1ALDH1A1ALOX15
SCHEMBL1657 0.83 CES2 (0.48) CES2CES1ALDH1A1ALOX15
SCHEMBL6538271 0.80 CES2 (0.46) CES2CES1ALDH1A1ALOX15
SCHEMBL2295776 0.80 ALDH1A1 (0.39) CES2CES1ALDH1A1ALOX15
SCHEMBL10920457 0.78 CES2 (0.39) CES2CES1ALDH1A1ALOX15
SCHEMBL19307720 0.77 CES2 (0.48) CES2CES1ALDH1A1ALOX15
SCHEMBL505527 0.76 MEN1 (0.33) CES2CES1
SCHEMBL10671409 0.76 ESR1 (0.39) CES2CES1ALDH1A1ALOX15
SCHEMBL9320500 0.76 CES2 (0.32) CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240376123-A1 KRAS G12D INHIBITORS AND USES THEREOF SUZHOU ZANRONG PHARMA LIMITED (CN) 2024-11-14 US disclosed
CN-117242079-A KRAS G12D inhibitors and uses thereof 苏州赞荣医药科技有限公司 2023-12-15 CN disclosed
WO-2023001141-A1 KRAS G12D INHIBITORS AND USES THEREOF SHANGHAI ZION PHARMA CO. LIMITED (CN) 2023-01-26 WO disclosed
US-5169853-A Antibacterial agents; administering to mammals for infection STERLING DRUG INC. (US) 1992-12-08 US disclosed
US-5075319-A Bactericides STERLING DRUG INC. (US) 1991-12-24 US disclosed
EP-0417669-A2 Pyridinyl-quinolone compounds, their preparation and use STERLING WINTHROP INC. (US) 1991-03-20 EP disclosed
US-4839355-A ANTIBACTERIAL AGENTS STERLING DRUG INC. (US) 1989-06-13 US disclosed
EP-0309789-A1 4-Oxo-3-quinolinecarboxylic acids useful as antibacterial agents and preparation thereof STERLING WINTHROP INC. (US) 1989-04-05 EP disclosed
EP-0306860-A2 4-Oxo-3-Quinolinecarboxylic acids useful as antibacterial agents and preparation thereof STERLING WINTHROP INC. (US) 1989-03-15 EP 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-20240376123-A1 KRAS G12D INHIBITORS AND USES THEREOF KRAS, NRAS, HRAS CES2 4851/4885CES1 3211/4885ALDH1A1 4016/4885

“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.