SCHEMBL4947133

SCHEMBL4947133

[NH]C(=O)COC(=O)Cc1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PAM P19021 1/20 0.72
ALDH1A1 P00352 2/20 0.63
MAPK1 P28482 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
KMT2A Q03164 2/20 0.57
TSHR P16473 1/20 0.50
MEN1 O00255 1/20 0.49
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
AKR1B1 P15121 1/20 0.48
MAPT P10636 1/20 0.47
CASP1 P29466 1/20 0.47
KLK7 P49862 1/20 0.47
MGLL Q99685 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL3748732 0.84 PAM (1.00) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL5999038 0.84 PAM (0.78) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL30952004 0.81 PAM (0.68) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL3673828 0.81 PAM (0.72) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL4947139 0.81 PAM (0.72) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL1434644 0.79 ALDH1A1 (0.73) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL6988546 0.79 PAM (0.70) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL10525631 0.79 ALDH1A1 (0.85) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL7716471 0.79 KMT2A (0.79) PAMALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL28102449 0.78 PAM (0.68) PAMALDH1A1MAPK1L3MBTL1KMT2A

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 82 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1319642-B1 Method of Preparing a Halogenated Compound OTSUKA KAGAKU KK (JP) 2008-03-26 EP disclosed
EP-1132391-B1 PROCESS FOR THE PREPARATION OF 3-SULFONYLOXY-3-CEPHEM COMPOUNDS OTSUKA KAGAKU KK (JP) 2006-11-15 EP disclosed
EP-1447406-B1 3-Cephem derivative crystal OTSUKA KAGAKU KK (JP) 2006-08-09 EP disclosed
US-6887992-B2 3-cephem derivative crystal OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2005-05-03 US disclosed
EP-1447406-A1 3-Cephem derivative crystal OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2004-08-18 EP disclosed
EP-0976700-B1 PROCESS FOR HALOGENATING HYDROXYL GROUP OTSUKA KAGAKU KK (JP) 2004-07-28 EP disclosed
EP-1061082-B1 PROCESS FOR THE PREPARATION OF BETA-HYDROXY ESTERS OTSUKA KAGAKU KK (JP) 2004-07-14 EP disclosed
EP-1227100-B1 3-CEPHEM DERIVATIVE CRYSTAL AND METHOD FOR PREPARING THE SAME OTSUKA KAGAKU KK (JP) 2004-05-26 EP disclosed
US-20040073023-A1 3-cephem derivative crystal MORIYOSHI TAKASHI (JP) 2004-04-15 US disclosed
EP-1209160-B1 PROCESS FOR THE PREPARATION OF CEPHEM COMPOUNDS OTSUKA KAGAKU KK (JP) 2004-03-10 EP disclosed
EP-0592677-A1 Beta-LACTAM COMPOUND AND CEPHEM COMPOUND, AND PRODUCTION THEREOF OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1994-04-20 EP disclosed
US-5204458-A Reacting an allenyl beta-lactam with a nucleophilic agent OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1993-04-20 US disclosed
US-5196530-A Cyclization with reducing metal OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1993-03-23 US disclosed
EP-0529081-A1 HALOGENATED $g(b)-LACTAM COMPOUND AND PRODUCTION OF 3-HYDROXYCEPHEM DERIVATIVE THEREFROM OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1993-03-03 EP disclosed
EP-0507124-A2 Process for preparing cephem derivatives OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1992-10-07 EP disclosed
EP-0503604-A2 Allenyl beta-lactam compounds and process for preparing same OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1992-09-16 EP disclosed
EP-0503603-A2 Process for preparing 2-exo-methylenepenam derivatives OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1992-09-16 EP disclosed
EP-0503597-A2 Penam derivatives and processes for producing the same OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1992-09-16 EP disclosed
US-5142040-A Oxidizing inpresence of oxygen with 3-halomethylcephem derivative OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1992-08-25 US disclosed
EP-0445821-A1 Process for preparing a 3-formylcephem derivative OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1991-09-11 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-20040073023-A1 3-cephem derivative crystal CRYAA, CRYAB, PCCA PAM 510/4885ALDH1A1 1731/4885MAPK1 4095/4885

“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.