SCHEMBL10543158

SCHEMBL10543158

CCN1CCN(C(=O)N[C@@H](C(=O)Cl)c2ccccc2)C(=O)C1=O

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.40
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CCKBR P32239 1/20 0.38
▸ MAPT P10636 2/20 0.38
▸ PDE3A Q14432 1/20 0.38
▸ SLC22A6 Q4U2R8 1/20 0.38
▸ SLC22A8 Q8TCC7 1/20 0.38
▸ SLC22A11 Q9NSA0 1/20 0.38
▸ THRB P10828 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ BRD4 O60885 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ EP300 Q09472 1/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ GAA P10253 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
SCHEMBL8600205 1.00 POLB (0.40) POLBMEN1KMT2ACCKBRMAPT
SCHEMBL7828421 0.90 ATM (0.42) POLBMEN1KMT2ACCKBRMAPT
SCHEMBL8597022 0.90 ATM (0.42) POLBMEN1KMT2ACCKBRMAPT
SCHEMBL28435235 0.89 MAPT (0.43) POLBMEN1KMT2AMAPTPDE3A
SCHEMBL28473803 0.89 MAPT (0.43) POLBMEN1KMT2AMAPTPDE3A
Water SCHEMBL8600954 0.89 ATM (0.42) POLBMEN1KMT2ACCKBRMAPT
SCHEMBL9814590 0.88 MEN1 (0.38) POLBMEN1KMT2ACCKBRMAPT
SCHEMBL10372875 0.88 GPR88 (0.39) POLBMEN1KMT2ACCKBRMAPT
SCHEMBL10754281 0.88 BRD4 (0.43) POLBKMT2AALDH1A1BRD4
SCHEMBL11093687 0.85 MC4R (0.37) POLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9334289-B2 Cephem compound having catechol or pseudo-catechol structure SHIONOGI & CO., LTD. (JP) 2016-05-10 — — US disclosed
US-9334289-B2 Cephem compound having catechol or pseudo-catechol structure SHIONOGI & CO., LTD. (JP) 2016-05-10 — — US disclosed
US-20140088302-A1 NOVEL CEPHEM COMPOUND HAVING CATECHOL OR PSEUDO-CATECHOL STRUCTURE SHIONOGI & CO., LTD. (JP) 2014-03-27 — — US disclosed
US-20140088302-A1 NOVEL CEPHEM COMPOUND HAVING CATECHOL OR PSEUDO-CATECHOL STRUCTURE SHIONOGI & CO., LTD. (JP) 2014-03-27 — — US disclosed
EP-2703406-A1 NOVEL CEPHEM COMPOUND HAVING CATECHOL OR PSEUDO-CATECHOL STRUCTURE Shionogi & Co., Ltd. (JP) 2014-03-05 — — EP disclosed
US-4820701-A Penam derivatives BEECHAM GROUP P.L.C. (GB) 1989-04-11 — — US disclosed
EP-0287734-A1 2-Beta-substituted methyl-penam derivatives BEECHAM GROUP PLC (GB) 1988-10-26 — — EP disclosed
US-4775670-A BACTERICIDES, ANTIBIOTICS E. R. SQUIBB & SONS, INC. (US) 1988-10-04 — — US disclosed
EP-0062876-B1 2-OXO-1-(((SUBSTITUTED SULFONYL)AMINO)CARBONYL)AZETIDINES E.R. Squibb & Sons, Inc. (US) 1986-09-24 — — EP disclosed
US-4587047-A 2-oxo-1-[[(substituted sulfonyl)amino]-carbonyl]azetidines E. R. SQUIBB & SONS, INC. (US) 1986-05-06 — — US disclosed
US-4529698-A Culturing Chromobacterium E. R. SQUIBB & SONS, INC. (US) 1985-07-16 — — US disclosed
EP-0076758-A2 4-Ether derivatives of 2-azetidinone-1-sulfonic acids E.R. Squibb & Sons, Inc. (US) 1983-04-13 — — EP disclosed
EP-0062876-A1 2-Oxo-1-(((substituted sulfonyl)amino)carbonyl)azetidines E.R. Squibb & Sons, Inc. (US) 1982-10-20 — — 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-20140088302-A1 NOVEL CEPHEM COMPOUND HAVING CATECHOL OR PSEUDO-CATECHOL STRUCTURE COMT, CMBL, CEP170 POLB 725/4885MEN1 3036/4885KMT2A 660/4885

“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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