SCHEMBL27189181

SCHEMBL27189181

COc1c(F)cc(C=O)c(F)c1OC

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 1/20 0.42
TSHR P16473 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
ERN1 O75460 11/20 0.40
MCL1 Q07820 1/20 0.40
PRKDC P78527 1/20 0.38
TRIM24 O15164 1/20 0.36
TYR P14679 1/20 0.36
TRIM33 Q9UPN9 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
SCHEMBL310426 0.88 ALDH1A1 (0.42) ALDH1A1KDM4ETSHRTDP1CA1
SCHEMBL4655024 0.88 ALDH1A1 (0.42) ALDH1A1KDM4ETSHRTDP1CA1
SCHEMBL27581741 0.84 ALDH1A1 (0.39) ALDH1A1KDM4ETSHRTDP1CA1
SCHEMBL5759448 0.84 PRKDC (0.44) ALDH1A1KDM4ETSHRTDP1CA1
SCHEMBL17263379 0.84 ALDH1A1 (0.53) ALDH1A1KDM4ETSHRTDP1ERN1
SCHEMBL31166894 0.83 ALDH1A1 (0.42) ALDH1A1KDM4ETSHRTDP1CA1
SCHEMBL7380240 0.82 ERN1 (0.47) CA1CA2ERN1TRIM24TYR
SCHEMBL29628787 0.82 ERN1 (0.39) ALDH1A1KDM4ETSHRTDP1CA1
SCHEMBL20607349 0.82 ERN1 (0.39) ALDH1A1KDM4ETSHRTDP1CA1
SCHEMBL5656538 0.82 MCL1 (0.44) ALDH1A1KDM4ETSHRTDP1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240270762-A1 PENICILLIN-BINDING PROTEIN INHIBITORS SPRING MILL PHARMA, INC. 2024-08-15 US disclosed
EP-4347607-A1 PENICILLIN-BINDING PROTEIN INHIBITORS Venatorx Pharmaceuticals, Inc. (US) 2024-04-10 EP disclosed
CN-117693511-A Penicillin binding protein inhibitors 维纳拓尔斯制药公司 2024-03-12 CN disclosed
CN-101085743-B Fluorine-containing alkoxy combretastatin derivative, preparation method and use thereof DADE PHARMACEUTICAL CO., LTD., ZHEJIANG PROV. (CN) 2012-02-15 CN disclosed
CN-101085743-A Fluorine-containing alkoxy combretastatin derivative, preparation method and use thereof ZHEJIANG DADE PHARMACEUTICAL C (CN) 2007-12-12 CN disclosed
CN-1142914-C New phenanthridines ��̹��ҽҩ��˾ 2004-03-24 CN disclosed
CN-1214681-A New phenanthridines BYK GULDEN LOMBERG CHEM FAB (DE) 1999-04-21 CN 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-20240270762-A1 PENICILLIN-BINDING PROTEIN INHIBITORS PEPD, BPGM, EBPL ALDH1A1 2794/4885KDM4E 2087/4885TSHR 4262/4885

“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.