SCHEMBL825346

SCHEMBL825346

COc1ccc(C=Cc2nc3ccccc3s2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.66
MAPT P10636 3/20 0.66
KMT2A Q03164 3/20 0.66
RAB9A P51151 3/20 0.66
SMN1; SMN2 Q16637 3/20 0.66
APP P05067 1/20 0.66
INSR P06213 1/20 0.66
NCOA1 Q15788 1/20 0.66
KDM4E B2RXH2 2/20 0.64
ALDH1A1 P00352 1/20 0.64
POLB P06746 1/20 0.64
GAA P10253 1/20 0.64
HTT P42858 1/20 0.64
NPC1 O15118 2/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2D6 P10635 1/20 0.61
CYP2C19 P33261 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
ATP4A P20648 15/20 0.61

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
SCHEMBL825345 1.00 MEN1 (0.66) MEN1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL29559249 0.87 MEN1 (0.77) MEN1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL319385 0.87 MEN1 (0.77) MEN1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL319386 0.87 MEN1 (0.77) MEN1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL6493243 0.87 MEN1 (0.70) MEN1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL6493241 0.87 MEN1 (0.70) MEN1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL13936229 0.85 ATP4A (0.66) MEN1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL8034148 0.85 RAB9A (0.60) MEN1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL17081873 0.83 MEN1 (0.71) MEN1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL4017956 0.83 RAB9A (0.54) MEN1MAPTKMT2ARAB9ASMN1; SMN2

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4063894-A CHROMOGEN, HYDROPEROXIDE, THIAZOLE SHIONOGI & CO., LTD. (JA) 1977-12-20 US claimed
US-12092643-B2 Detecting targets using mass tags and mass spectrometry Ventana Medic Systems, Inc. (US) 2024-09-17 US disclosed
US-20210063411-A1 DETECTING TARGETS USING MASS TAGS AND MASS SPECTROMETRY VENTANA MED SYST INC (US) 2021-03-04 US disclosed
US-10883999-B2 Detecting targets using mass tags and mass spectrometry VENTANA MEDICAL SYSTEMS, INC. (US) 2021-01-05 US disclosed
US-20190004061-A1 DETECTING TARGETS USING MASS TAGS AND MASS SPECTROMETRY VENTANA MED SYST INC (US) 2019-01-03 US disclosed
US-10078083-B2 Detecting targets using mass tags and mass spectrometry VENTANA MEDICAL SYSTEMS, INC. (US) 2018-09-18 US disclosed
EP-2588144-B1 DETECTING TARGETS USING MASS TAGS AND MASS SPECTROMETRY VENTANA MED SYST INC (US) 2018-05-09 EP disclosed
US-20160139143-A1 DETECTING TARGETS USING MASS TAGS AND MASS SPECTROMETRY VENTANA MEDICAL SYSTEMS, INC. 2016-05-19 US disclosed
US-9291597-B2 Detecting targets using mass tags and mass spectrometry VENTANA MEDICAL SYSTEMS, INC. (US) 2016-03-22 US disclosed
US-20130122516-A1 DETECTING TARGETS USING MASS TAGS AND MASS SPECTROMETRY VENTANA MEDICAL SYSTEMS, INC. 2013-05-16 US disclosed
EP-2588144-A2 DETECTING TARGETS USING MASS TAGS AND MASS SPECTROMETRY Ventana Medical Systems, Inc. (US) 2013-05-08 EP disclosed
WO-2012003478-A2 DETECTING TARGETS USING MASS TAGS AND MASS SPECTROMETRY VENTANA MEDICAL SYSTEMS, INC. (US) 2012-01-05 WO disclosed
US-20050260126-A1 Diagnostic probes and remedies for diseases with accumulation of prion protein, and stains for prion protein BF RESEARCH INSTITUTE (JP) 2005-11-24 US disclosed
US-4063894-A CHROMOGEN, HYDROPEROXIDE, THIAZOLE SHIONOGI & CO., LTD. (JA) 1977-12-20 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 (1 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-20050260126-A1 Diagnostic probes and remedies for diseases with accumulation of prion protein, and stains for prion protein PRNP, PRPH, PCNP MEN1 3565/4885MAPT 7/4885KMT2A 3291/4885

“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.