SCHEMBL523698

SCHEMBL523698

C[C@H](c1ccccc1)N1C[C@H](C(=O)O)CC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 1.00
MAPT P10636 2/20 0.66
MAPK1 P28482 1/20 0.65
ALOX15 P16050 1/20 0.53
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49
POLB P06746 2/20 0.48
PTPN1 P18031 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.43
RECQL P46063 1/20 0.42

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
SCHEMBL14659880 1.00 KMT2A (1.00) KMT2AMAPTMAPK1ALOX15CASP1
SCHEMBL1713616 1.00 KMT2A (1.00) KMT2AMAPTMAPK1ALOX15CASP1
SCHEMBL12316010 1.00 KMT2A (1.00) KMT2AMAPTMAPK1ALOX15CASP1
SCHEMBL27626477 1.00 KMT2A (1.00) KMT2AMAPTMAPK1ALOX15CASP1
SCHEMBL1713614 1.00 KMT2A (1.00) KMT2AMAPTMAPK1ALOX15CASP1
SCHEMBL739575 1.00 KMT2A (1.00) KMT2AMAPTMAPK1ALOX15CASP1
SCHEMBL1263214 1.00 KMT2A (1.00) KMT2AMAPTMAPK1ALOX15CASP1
SCHEMBL3659883 1.00 KMT2A (1.00) KMT2AMAPTMAPK1ALOX15CASP1
SCHEMBL522714 0.90 KMT2A (0.81) KMT2AMAPTMAPK1ALOX15POLB
SCHEMBL522715 0.90 KMT2A (0.81) KMT2AMAPTMAPK1ALOX15POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11851449-B2 Heterocyclic amide compounds having an RORvt inhibitory action TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-12-26 US disclosed
EP-3018123-B1 AMIDE COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2023-05-10 EP disclosed
CN-115003673-A Dihydropyrimidine compound, and preparation method and application thereof 上海维申医药有限公司 2022-09-02 CN disclosed
CN-114621219-A Dihydropyrimidine compound, and preparation method and application thereof 上海维申医药有限公司 2022-06-14 CN disclosed
US-20210277030-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-09-09 US disclosed
US-11053262-B2 Heterocyclic amide compounds having RORyT inhibitory action TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-07-06 US disclosed
US-10472376-B2 Amide compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-11-12 US disclosed
US-20170152258-A9 Substituted Pyridopyrazines as Syk Inhibitors HUTCHISON MEDIPHARMA LIMITED (CN) 2017-06-01 US disclosed
US-20170152258-A9 Substituted Pyridopyrazines as Syk Inhibitors HUTCHISON MEDIPHARMA LIMITED (CN) 2017-06-01 US disclosed
US-20170107240-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-04-20 US disclosed
EP-1262477-A1 ANTI-ACID-FAST BACTERIAL AGENTS CONTAINING PYRIDONECARBOXYLIC ACIDS AS THE ACTIVE INGREDIENT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2002-12-04 EP disclosed
EP-1258478-A1 PROCESS FOR PRODUCING QUINOLONECARBOXYLIC ACIDS AND INTERMEDIATES THEREOF DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2002-11-20 EP disclosed
EP-0900793-B1 CYCLOALKYLAMINOMETHYLPYRROLIDINE DERIVATIVES DAIICHI SEIYAKU CO (JP) 2002-07-24 EP disclosed
EP-1182202-A1 AMINOMETHYLPYRROLIDINE DERIVATIVES HAVING AROMATIC SUBSTITUENTS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2002-02-27 EP disclosed
EP-1134219-A1 CYCLOALKYL-SUBSTITUTED AMINOMETHYLPYRROLIDINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-09-19 EP disclosed
US-6194434-B1 MICROBIOCIDES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-02-27 US disclosed
EP-0900793-A1 CYCLOALKYLAMINOMETHYLPYRROLIDINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-03-10 EP disclosed
US-5864039-A THERAPEUTIC TREATMENT OF VARIOUS GASTROINTESTINAL DISEASES, CENTRAL NERVOUS DISORDERS, CARDIOVASCULAR DISORDERS, URINARY DISEASES, UROGENITAL DISORDERS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1999-01-26 US disclosed
EP-0774460-A1 BENZOIC ACID COMPOUND AND USE THEREOF AS MEDICINE YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-05-21 EP disclosed
US-5281612-A Naphthyridine antibacterial agents WARNER-LAMBERT COMPANY (US) 1994-01-25 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 (6 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-20170107240-A1 AMIDE COMPOUND RORB, RORC, RORA KMT2A 236/4885MAPT 1775/4885MAPK1 1309/4885
US-20210277030-A1 AMIDE COMPOUND RORB, RORC, RORA KMT2A 236/4885MAPT 1775/4885MAPK1 1309/4885
US-20170152258-A9 Substituted Pyridopyrazines as Syk Inhibitors SYK, BTK, LYN KMT2A 597/4885MAPT 3971/4885MAPK1 935/4885
US-11851449-B2 Heterocyclic amide compounds having an RORvt inhibitory action RORB, RORC, RORA KMT2A 251/4885MAPT 2013/4885MAPK1 1010/4885
US-11053262-B2 Heterocyclic amide compounds having RORyT inhibitory action RORC, RORB, RORA KMT2A 423/4885MAPT 2804/4885MAPK1 1258/4885
US-10472376-B2 Amide compound RORB, RORC, RORA KMT2A 236/4885MAPT 1775/4885MAPK1 1309/4885

“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.