SCHEMBL2532477

SCHEMBL2532477

c1ccc(Cn2cnnn2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 9/20 0.55
HMOX1 P09601 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MAPK1 P28482 1/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 2/20 0.48
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 1/20 0.47
NOTUM Q6P988 1/20 0.45
TP53 P04637 1/20 0.45
LTA4H P09960 1/20 0.42
POLB P06746 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
TBXAS1 P24557 1/20 0.41

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
SCHEMBL9978689 0.98 CYP19A1 (0.53) CYP19A1HMOX1L3MBTL1KDM4EMAPK1
SCHEMBL10289108 0.89 HSP90AB1 (0.49) CYP19A1HMOX1L3MBTL1KDM4EMAPK1
SCHEMBL31415785 0.85 CYP19A1 (0.61) CYP19A1
SCHEMBL10965028 0.82 KDM4E (0.50) CYP19A1HMOX1L3MBTL1KDM4EMAPK1
SCHEMBL23913862 0.82 MAPK1 (0.53) CYP19A1HMOX1L3MBTL1KDM4EMAPK1
SCHEMBL10066409 0.82 MEN1 (0.54) CYP19A1HMOX1L3MBTL1KDM4EMAPK1
SCHEMBL9584318 0.82 KDM4E (0.49) CYP19A1HMOX1L3MBTL1KDM4EMAPK1
SCHEMBL10053477 0.80 MEN1 (0.53) CYP19A1L3MBTL1KDM4EMAPK1MEN1
SCHEMBL708243 0.80 KDM4E (0.51) CYP19A1HMOX1L3MBTL1KDM4EMAPK1
SCHEMBL21708921 0.78 ALDH1A1 (0.59) HMOX1L3MBTL1KDM4EMAPK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118909015-A Special-shaped nucleoside dimer phosphoramidite and synthesis method thereof 上海科泽永欣生物科技有限公司 2024-11-08 CN claimed
CN-1186332-C Novel thyroid receptor ligands and method II KAROBIO AB (SE) 2005-01-26 CN claimed
CN-1337953-A Novel thyroid receptor ligands and method II KAROBIO AB (SE) 2002-02-27 CN claimed
EP-0835252-A1 TRIAZOLE ANTIFUNGAL AGENTS Pfizer Research and Development Company, N.V./S.A. (IE) 1998-04-15 EP claimed
CN-118909015-A Special-shaped nucleoside dimer phosphoramidite and synthesis method thereof 上海科泽永欣生物科技有限公司 2024-11-08 CN disclosed
US-20240276957-A1 METHODS OF TREATMENT WITH AMINOLEVULINIC ACID SYNTHASE 2 (ALAS2) MODULATORS AGIOS PHARMACEUTICALS, INC. 2024-08-22 US disclosed
US-11845767-B2 Arginase inhibitors RIJKSUNIVERSITEIT GRONINGEN (NL) 2023-12-19 US disclosed
US-20230321067-A1 DOSING REGIMEN COMPRISING 3-(1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH INC. 2023-10-12 US disclosed
CN-116496326-A Process for the preparation of oligomeric compounds 南京金斯瑞生物科技有限公司 2023-07-28 CN disclosed
US-20230174933-A1 METHODS OF MAKING CHIMERIC ANTIGEN RECEPTOR-EXPRESSING CELLS NOVARTIS AG (CH) 2023-06-08 US disclosed
US-20220251152-A1 COMPOSITIONS AND METHODS FOR SELECTIVE PROTEIN DEGRADATION NOVARTIS AG (CH) 2022-08-11 US disclosed
US-20220227791-A1 NOVEL ARGINASE INHIBITORS RIJKSUNIVERSITEIT GRONINGEN (NL) 2022-07-21 US disclosed
US-5278316-A Indoles WARNER-LAMBERT COMPANY (US) 1994-01-11 US disclosed
CN-1064485-A IMIDAZOLE, TRIAZOLE AND TETRAZOLE DERIVATIVES MERCK SHARP & DOHME (GB) 1992-09-16 CN disclosed
EP-0497512-A2 Imidazole, triazole and tetrazole derivatives MERCK SHARP & DOHME LTD. (GB) 1992-08-05 EP disclosed
EP-0479910-A1 N-SUBSTITUTED CYCLOALKYL AND POLYCYCLOALKYL ALPHA-SUBSTITUTED Trp-Phe- AND PHENETHYLAMINE DERIVATIVES WARNER-LAMBERT COMPANY (US) 1992-04-15 EP disclosed
US-4992544-A Intermediates for b-lactam antibiotics and b-lactamase inhibitor UNIVERSITY OF NOTRE DAME DU LAC (US) 1991-02-12 US disclosed
WO-1991000274-A1 N-SUBSTITUTED CYCLOALKYL AND POLYCYCLOALKYL ALPHA-SUBSTITUTED TRP-PHE- AND PHENETHYLAMINE DERIVATIVES WARNER-LAMBERT COMPANY (US) 1991-01-10 WO disclosed
EP-0405537-A1 N-substituted cycloalkyl and polycycloalkyl alpha-substituted Trp-Phe- and phenethylamine derivatives WARNER-LAMBERT COMPANY (US) 1991-01-02 EP disclosed
EP-0114128-B1 3-AMINO-2-OXO-AZETIDINE DERIVATIVES CONTAINING IN POSITION 1 A NITROGEN HETEROCYCLIC RADICAL, PROCESS FOR THEIR PREPARATION, THEIR USE AS THERAPEUTICAL AGENTS AND INTERMEDIATES FOR THEIR PREPARATION ROUSSEL-UCLAF (FR) 1989-03-22 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 (5 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-20220227791-A1 NOVEL ARGINASE INHIBITORS ARG1, ARG2, ARGLU1 CYP19A1 464/4885HMOX1 81/4885L3MBTL1 4661/4885
US-20230321067-A1 DOSING REGIMEN COMPRISING 3-(1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES IKZF1, IKZF2, IKZF3 CYP19A1 2482/4885HMOX1 512/4885L3MBTL1 646/4885
US-20230174933-A1 METHODS OF MAKING CHIMERIC ANTIGEN RECEPTOR-EXPRESSING CELLS HAVCR2, MICA, CD74 CYP19A1 4729/4885HMOX1 3265/4885L3MBTL1 1143/4885
US-11845767-B2 Arginase inhibitors ARG1, ARG2, ARGLU1 CYP19A1 425/4885HMOX1 61/4885L3MBTL1 4634/4885
US-20220251152-A1 COMPOSITIONS AND METHODS FOR SELECTIVE PROTEIN DEGRADATION RPS27A, PSMG3, PREP CYP19A1 3749/4885HMOX1 3021/4885L3MBTL1 1833/4885

“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.