SCHEMBL29569

SCHEMBL29569

O=C1COc2cccnc2N1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.45
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
NR3C2 P08235 7/20 0.43
MMP12 P39900 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MALT1 Q9UDY8 1/20 0.38
NR3C1 P04150 1/20 0.38
CYP1A2 P05177 1/20 0.38
RIPK1 Q13546 1/20 0.37
PARP1 P09874 1/20 0.37
MAPT P10636 1/20 0.37
MAOB P27338 1/20 0.37
ATM Q13315 1/20 0.37

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
SCHEMBL29397815 1.00 NPC1 (0.45) NPC1CYP11B1CYP11B2NR3C2MMP12
Hydrochloric Acid SCHEMBL30048713 0.98 NPC1 (0.44) NPC1CYP11B1CYP11B2NR3C2MMP12
SCHEMBL30987426 0.83 NPC1 (0.43) NPC1SMN1; SMN2CYP1A2RIPK1
SCHEMBL7320965 0.83 NPC1 (0.43) NPC1SMN1; SMN2CYP1A2RIPK1
Hydrochloric Acid SCHEMBL30987420 0.81 NPC1 (0.42) NPC1SMN1; SMN2KMT2ACYP1A2RIPK1
SCHEMBL9755357 0.77 CRBN (0.39) NPC1CYP11B1CYP11B2SMN1; SMN2CYP1A2
Bicarbonate SCHEMBL30250613 0.77 NPC1 (0.42) NPC1NR3C2SMN1; SMN2KMT2ACYP1A2
SCHEMBL14279297 0.76 CYP1A2 (0.42) SMN1; SMN2KMT2ANPSR1CYP1A2
SCHEMBL19228635 0.73 NPC1 (0.48) NPC1SMN1; SMN2KMT2ACYP1A2RIPK1
SCHEMBL2840325 0.73 NPC1 (0.55) NPC1SMN1; SMN2ALDH1A1CYP1A2RIPK1

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 1475 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3768675-B1 NOVEL TRIAZOLONE DERIVATIVES OR SALTS THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME YUHAN CORP (KR) 2026-04-01 EP claimed
US-12577248-B2 Substituted [1,2,4]triazolo[1,5-a]pyrazines as spleen tyrosine kinase inhibitors NANJING RUIJIE PHARMA CO., LTD. (CN) 2026-03-17 US claimed
EP-4126855-B1 COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTIONS HOFFMANN LA ROCHE (CH) 2024-04-24 EP claimed
US-11780830-B2 Triazolone derivatives or salts thereof and pharmaceutical compositions comprising the same YUHAN CORPORATION (KR) 2023-10-10 US claimed
EP-3458452-B1 HETEROCYCLIC COMPOUNDS USEFUL AS ANTI-BACTERIAL AGENTS AND METHOD FOR PRODUCTION BUGWORKS RES INC (US) 2023-08-30 EP claimed
EP-3717490-B1 ANTI-BACTERIAL HETEROCYCLIC COMPOUNDS AND THEIR SYNTHESIS BUGWORKS RES INC (US) 2023-05-24 EP claimed
EP-4126855-A1 COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTION F. Hoffmann-La Roche AG (CH) 2023-02-08 EP claimed
EP-3774790-B1 OXAZOLIDINONE ANTIBIOTIC COMPOUNDS AND PROCESS OF PREPARATION BUGWORKS RES INC (US) 2023-01-25 EP claimed
EP-3634968-B1 HETEROCYCLIC COMPOUNDS USEFUL AS ANTI-BACTERIAL AGENTS AND METHOD FOR PRODUCTION THEREOF BUGWORKS RES INC (US) 2023-01-25 EP claimed
US-11492335-B2 Aryl or heteroaryl triazolone derivatives or salts thereof, or pharmaceutical compositions comprising the same YUHAN CORPORATION (KR) 2022-11-08 US claimed
WO-2009151683-A2 QUINOLINONE FARNESYL TRANSFERASE INHIBITORS FOR THE TREATMENT OF SYNUCLEINOPATHIES AND OTHER INDICATIONS LINK MEDICINE CORPORATION (US) 2009-12-17 WO claimed
EP-2007377-A2 ANTIBACTERIAL AGENTS Glaxo Group Limited (GB) 2008-12-31 EP claimed
WO-2007118130-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2007-10-18 WO claimed
EP-1021190-B1 Amid derivatives as growth hormone release promotors KAKEN PHARMA CO LTD (JP) 2006-11-08 EP claimed
EP-1560488-A4 ANTIBACTERIAL AGENTS SMITHKLINE BEECHAM CORP (US) 2006-08-02 EP claimed
EP-1560488-A2 ANTIBACTERIAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2005-08-10 EP claimed
WO-2004041210-A2 ANTIBACTERIAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2004-05-21 WO claimed
EP-0357675-A4 PYRIDOOXAZINONE-PYRIDONE COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING THE SAME, AND THEIR USES 1992-01-15 EP claimed
EP-0357675-A1 PYRIDOOXAZINONE-PYRIDONE COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING THE SAME, AND THEIR USES RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1990-03-14 EP claimed
WO-1988008705-A1 PYRIDOOXAZINONE-PYRIDONE COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING THE SAME, AND THEIR USES RORER INTERNATIONAL (OVERSEAS) INC. (US) 1988-11-17 WO claimed

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-11492335-B2 Aryl or heteroaryl triazolone derivatives or salts thereof, or pharmaceutical compositions comprising the same CYP7A1, NAT1, NCOA1 NPC1 21/4885CYP11B1 221/4885CYP11B2 445/4885
US-11780830-B2 Triazolone derivatives or salts thereof and pharmaceutical compositions comprising the same SLC10A1, VAT1, LIPC NPC1 20/4885CYP11B1 449/4885CYP11B2 885/4885
US-12577248-B2 Substituted [1,2,4]triazolo[1,5-a]pyrazines as spleen tyrosine kinase inhibitors SYK, BTK, TYRO3 NPC1 3649/4885CYP11B1 2581/4885CYP11B2 2643/4885

“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.