SCHEMBL23391578

SCHEMBL23391578

COc1cc(Cl)ccc1Oc1c(Cl)cc(B2OC(C)(C)C(C)(C)O2)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 2/20 0.40
▸ TRPV4 Q9HBA0 1/20 0.39
▸ SLC6A4 P31645 8/20 0.38
▸ SLC6A2 P23975 7/20 0.38
▸ SLC6A3 Q01959 5/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ EGFR P00533 2/20 0.35
▸ TSHR P16473 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ CSF1R P07333 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ AAK1 Q2M2I8 1/20 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
SCHEMBL3239432 0.78 LPL (0.38) CSF1RAAK1
SCHEMBL23407744 0.76 TTR (0.40) TTRTRPV4SLC6A4SLC6A2SLC6A3
SCHEMBL121746 0.74 EGFR (0.42) TTRSLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL23391525 0.74 TTR (0.48) TTRTRPV4SLC6A4SLC6A2SLC6A3
SCHEMBL23391597 0.74 TTR (0.48) TTRTRPV4SLC6A4SLC6A2SLC6A3
SCHEMBL16655541 0.74 CSF1R (0.37) EGFRCSF1RAAK1
SCHEMBL5892464 0.74 EGFR (0.47) TTRTRPV4EGFRTSHRMAPK1
SCHEMBL16282205 0.74 EGFR (0.47) TRPV4SLC6A4SLC6A2SLC6A3KCNH2
SCHEMBL18186470 0.74 LPL (0.35) CSF1RAAK1
SCHEMBL1130429 0.74 LPL (0.41) TTRSLC6A4SLC6A2SLC6A3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4063373-A1 NOVEL METALLO-BETA-LACTAMASE INHIBITOR CREATED IN MULTI-DRUG RESISTANT BACTERIA, AND PREPARATION METHOD THEREFOR Myongji University Industry and Academia Cooperation Foundation (KR) 2022-09-28 — — EP disclosed
US-11395829-B2 Inhibitors of metallo-beta-lactamases produced by multidrug-resistant bacteria MYONGJI UNIVERSITY INDUSTRY AND ACADEMIA COOPERATION FOUNDATION (KR) 2022-07-26 — — US disclosed
US-11395829-B2 Inhibitors of metallo-beta-lactamases produced by multidrug-resistant bacteria MYONGJI UNIVERSITY INDUSTRY AND ACADEMIA COOPERATION FOUNDATION (KR) 2022-07-26 — — US disclosed
CN-113195505-A Inhibitors of metallo-beta-lactamase produced by multi-drug resistant bacteria and methods of preparing the same 明知大学校产学协力团 2021-07-30 — — CN disclosed
US-20210154216-A1 INHIBITORS OF METALLO-BETA-LACTAMASES PRODUCED BY MULTIDRUG-RESISTANT BACTERIA MYONGJI UNIVERSITY INDUSTRY AND ACADEMIA COOPERATION FOUNDATION (KR) 2021-05-27 — — 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 (2 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-20210154216-A1 INHIBITORS OF METALLO-BETA-LACTAMASES PRODUCED BY MULTIDRUG-RESISTANT BACTERIA MANBA, MGAM, GUSB TTR 4399/4885TRPV4 4657/4885SLC6A4 4430/4885
US-11395829-B2 Inhibitors of metallo-beta-lactamases produced by multidrug-resistant bacteria MANBA, MGAM, GUSB TTR 4399/4885TRPV4 4657/4885SLC6A4 4430/4885

“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.

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