SCHEMBL7754741

SCHEMBL7754741

Cc1ccc(CNO)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.56
IDO1 P14902 2/20 0.56
KMT2A Q03164 6/20 0.52
MEN1 O00255 4/20 0.52
KDM4E B2RXH2 3/20 0.52
HPGD P15428 3/20 0.52
ALDH1A1 P00352 2/20 0.52
POLB P06746 1/20 0.52
HSP90AA1 P07900 1/20 0.52
HSP90AB1 P08238 1/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
ALOX15 P16050 1/20 0.52
MAPK1 P28482 1/20 0.52
CASP1 P29466 1/20 0.52
BLM P54132 1/20 0.52
PLEC Q15149 1/20 0.52
HSD17B10 Q99714 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
SMN1; SMN2 Q16637 2/20 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
Toluene SCHEMBL28370603 0.83 IDO1 (0.77) THRBIDO1KMT2AMEN1KDM4E
SCHEMBL842161 0.78 CHRM2 (0.67) THRBIDO1KMT2AMEN1KDM4E
SCHEMBL296509 0.76 MAPT (0.56) THRBIDO1KMT2AMEN1KDM4E
SCHEMBL6895044 0.76 THRB (0.59) THRBIDO1KMT2AMEN1POLB
SCHEMBL17065246 0.76 THRB (0.59) THRBIDO1KMT2AMEN1KDM4E
SCHEMBL30183425 0.75 NPC1 (0.50) IDO1KMT2AMEN1HPGDALDH1A1
SCHEMBL13853400 0.75 CHRM2 (0.57) THRBKMT2AMEN1KDM4EHPGD
SCHEMBL9994731 0.74 CHRM2 (0.50) THRBIDO1KMT2AMEN1KDM4E
SCHEMBL1505831 0.74 MEN1 (0.58) THRBIDO1KMT2AMEN1KDM4E
SCHEMBL131948 0.74 IDO1 (0.56) THRBIDO1NOS1NOS2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240294470-A1 FRAGRANCE COMPOUNDS GIVAUDAN SA (CH) 2024-09-05 US disclosed
EP-4355728-A1 FRAGRANCE COMPOUNDS Givaudan SA (CH) 2024-04-24 EP disclosed
CN-117500783-A Perfume compounds 奇华顿股份有限公司 2024-02-02 CN disclosed
CN-116745311-A Novel antimicrobial peptides having excellent cytoplasmic elution effect of microorganisms 愢丽科恩株式会社 2023-09-12 CN disclosed
WO-2022263605-A1 FRAGRANCE COMPOUNDS GIVAUDAN SA (CH) 2022-12-22 WO disclosed
WO-2022261956-A1 FRAGRANCE COMPOUNDS GIVAUDAN SA (CH) 2022-12-22 WO disclosed
CN-114269367-A Therapeutic peptides 科巴公司 2022-04-01 CN disclosed
EP-3305900-B1 ENZYMATIC ENCODING METHODS FOR EFFICIENT SYNTHESIS OF LARGE LIBRARIES NUEVOLUTION AS (DK) 2021-07-21 EP disclosed
US-10954225-B2 Selective NR2B antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2021-03-23 US disclosed
US-10954225-B2 Selective NR2B antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2021-03-23 US disclosed
US-20120234316-A1 ISOXAZOLIDINE DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2012-09-20 US disclosed
US-20120234316-A1 ISOXAZOLIDINE DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2012-09-20 US disclosed
WO-2012123482-A2 ISOXAZOLIDINE DERIVATIVES CHIESI FARMACEUTICI S.P.A. (IT) 2012-09-20 WO disclosed
EP-1732882-B1 NON-GLYCOSYLATED/NON-GLYCOSIDIC/NON-PEPTIDIC SMALL MOLECULE PSGL-1 MIMETICS FOR THE TREATMENT OF INFLAMMATORY DISORDERS REVOTAR BIOPHARMACEUTICALS AG (DE) 2012-07-04 EP disclosed
EP-2253328-A1 Cycloalkyl inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2010-11-24 EP disclosed
US-7335770-B2 Triazine compounds and their analogs, compositions, and methods REDDY U5 THERAPEUTICS, INC. (US) 2008-02-26 US disclosed
US-6242564-B1 ADMINISTERING PEPTIDE OF DEFINED AMINO ACID SEQUENCE ADVANCED IMMUNI T, INC. 2001-06-05 US disclosed
EP-0579363-B1 Treatment of tropical spastic paresis with peptide T ADVANCED PEPTIDES & BIOTECH (US) 2001-01-31 EP disclosed
US-5534495-A ADMINISTERING LINEAR OLIGOPEPTIDE ADVANCED PEPTIDES AND BIOTECHNOLOGY SCIENCES (US) 1996-07-09 US disclosed
EP-0579363-A1 Treatment of tropical spastic paresis with peptide T ADVANCED PEPTIDES AND BIOTECHNOLOGY SCIENCES (US) 1994-01-19 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 (3 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-20120234316-A1 ISOXAZOLIDINE DERIVATIVES IL5, TSLP, SERPINA6 THRB 1391/4885IDO1 277/4885KMT2A 4240/4885
US-20240294470-A1 FRAGRANCE COMPOUNDS FASN, FAAH2, FADS2 THRB 3345/4885IDO1 2682/4885KMT2A 2060/4885
US-10954225-B2 Selective NR2B antagonists GRIN2B, GRIN2A, GRIN1 THRB 349/4885IDO1 4175/4885KMT2A 2099/4885

“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.