SCHEMBL7652554

SCHEMBL7652554

COc1ccc(CNC(=O)OC(C)(C)C)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.58
RAB9A P51151 3/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
EPHX2 P34913 1/20 0.58
NR1H4 Q96RI1 1/20 0.58
ALDH1A1 P00352 5/20 0.56
PKM P14618 1/20 0.56
HPGD P15428 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 2/20 0.52
MAPT P10636 1/20 0.52
GAA P10253 1/20 0.51
HTT P42858 1/20 0.51
NAMPT P43490 1/20 0.51
HDAC1 Q13547 1/20 0.50

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
SCHEMBL16192927 0.93 NPC1 (0.52) NPC1RAB9AL3MBTL1MEN1KMT2A
SCHEMBL3180689 0.90 L3MBTL1 (0.61) L3MBTL1MAPTGAANAMPTHDAC1
SCHEMBL3413772 0.90 NPC1 (0.55) NPC1RAB9AL3MBTL1MEN1KMT2A
SCHEMBL11957489 0.87 L3MBTL1 (0.53) NPC1RAB9AL3MBTL1MEN1KMT2A
SCHEMBL21066545 0.87 KMT2A (0.52) NPC1RAB9AL3MBTL1MEN1KMT2A
SCHEMBL28230906 0.86 ALDH1A1 (0.63) NPC1RAB9AL3MBTL1MEN1KMT2A
SCHEMBL24011214 0.85 CASR (0.53) NPC1RAB9AL3MBTL1MEN1KMT2A
SCHEMBL2721206 0.84 ALDH1A1 (0.65) NPC1RAB9AL3MBTL1MEN1KMT2A
SCHEMBL7551243 0.84 L3MBTL1 (0.51) NPC1RAB9AL3MBTL1MEN1KMT2A
SCHEMBL482239 0.84 L3MBTL1 (0.51) NPC1RAB9AL3MBTL1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114957219-B Degradation agent for targeted degradation of Gli1 protein, preparation method and application thereof 苏州大学 2023-12-15 CN claimed
CN-114957219-A Degradation agent for targeted degradation of Gli1 protein and preparation method and application thereof 苏州大学 2022-08-30 CN claimed
JP-2002500641-A 2002-01-08 JP claimed
EP-0998451-A1 SUBSTITUTED 3,3-DIAMINO-2-PROPENENITRILES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-05-10 EP claimed
WO-1998050344-A1 SUBSTITUTED 3,3-DIAMINO-2-PROPENENITRILES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1998-11-12 WO claimed
US-20250391519-A1 CHEMICAL SYNTHESIS PLATFORM UNIV GLASGOW COURT (GB) 2025-12-25 US disclosed
CN-119968369-A Cytotoxic imidazo [1,2-a ] pyridine compounds and their use in therapy 迈里克斯制药有限公司 2025-05-09 CN disclosed
EP-4548355-A1 CHEMICAL SYNTHESIS PLATFORM The University Court Of The University Of Glasgow (GB) 2025-05-07 EP disclosed
CN-118401516-A TYK2 inhibitors, compositions and methods thereof 凌科药业(杭州)有限公司 2024-07-26 CN disclosed
CN-118344346-A Heterocyclic compounds and their use 武田药品工业株式会社 2024-07-16 CN disclosed
CN-118290408-A Heterocyclic compounds and their use 武田药品工业株式会社 2024-07-05 CN disclosed
CN-118271297-A Heterocyclic compounds and their use 武田药品工业株式会社 2024-07-02 CN disclosed
US-9439890-B2 Triazolone compounds as mPGES-1 inhibitors GLENMARK PHARMACEUTICALS S.A. (CH) 2016-09-13 US disclosed
CN-105408335-A Pyrazolopyrrolidine derivatives and their use in the treatment of disease NOVARTIS AG 2016-03-16 CN disclosed
US-20150283117-A1 TRIAZOLONE COMPOUNDS AS mPGES-1 INHIBITORS Ichnos Sciences SA (CH) 2015-10-08 US disclosed
US-9096545-B2 Triazolone compounds as mPGES-1 inhibitors GLENMARK PHARMACEUTICALS S.A. (CH) 2015-08-04 US disclosed
US-20150087646-A1 TRIAZOLONE COMPOUNDS AS mPGES-1 INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2015-03-26 US disclosed
US-7981874-B2 Phosphorus derivatives as histone deacetylase inhibitors MERCK SHARP & DOHME CORP. (US) 2011-07-19 US disclosed
US-20110059940-A1 2-Aryl Glycinamide Derivatives BRISTOL- MYERS SQUIBB COMPANY 2011-03-10 US disclosed
US-20090270351-A1 PHOSPHORUS DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS MERCK SHARP & DOHME CORP. 2009-10-29 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 (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-20150283117-A1 TRIAZOLONE COMPOUNDS AS mPGES-1 INHIBITORS PTGES, PTGIS, PTGS1 NPC1 1058/4885RAB9A 1553/4885L3MBTL1 4576/4885
US-20150087646-A1 TRIAZOLONE COMPOUNDS AS mPGES-1 INHIBITORS PTGES, PTGS1, PTGIS NPC1 1186/4885RAB9A 2963/4885L3MBTL1 4389/4885
US-20110059940-A1 2-Aryl Glycinamide Derivatives IAPP, APP, BACE1 NPC1 254/4885RAB9A 908/4885L3MBTL1 4639/4885
US-20250391519-A1 CHEMICAL SYNTHESIS PLATFORM SET, CBS, COASY NPC1 849/4885RAB9A 3727/4885L3MBTL1 3322/4885
US-20090270351-A1 PHOSPHORUS DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS HDAC5, PPM1A, PTEN NPC1 3735/4885RAB9A 4443/4885L3MBTL1 2929/4885

“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.