SCHEMBL12909280

SCHEMBL12909280

COc1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c(C)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.59
KMT2A Q03164 5/20 0.59
USP2 O75604 4/20 0.59
POLB P06746 3/20 0.59
ATM Q13315 1/20 0.59
PLEC Q15149 1/20 0.59
L3MBTL1 Q9Y468 2/20 0.54
MAPT P10636 3/20 0.51
CYP3A4 P08684 3/20 0.51
CYP2C9 P11712 3/20 0.51
CYP2C19 P33261 3/20 0.51
TP53 P04637 2/20 0.51
TNKS O95271 1/20 0.51
TNKS2 Q9H2K2 1/20 0.51
ESR1 P03372 2/20 0.50
ESR2 Q92731 1/20 0.50
ALPL P05186 1/20 0.50
ALPI P09923 1/20 0.50
ALPG P10696 1/20 0.50
KDM4E B2RXH2 4/20 0.49

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
SCHEMBL16808265 0.92 ALDH1A1 (0.51) MEN1KMT2AUSP2POLBATM
SCHEMBL12909301 0.89 USP2 (0.68) MEN1KMT2AUSP2POLBATM
SCHEMBL12909292 0.89 MEN1 (0.59) MEN1KMT2AUSP2POLBATM
SCHEMBL18504843 0.88 MAOB (0.49) MEN1KMT2AUSP2POLBATM
SCHEMBL12909289 0.88 MEN1 (0.59) MEN1KMT2AUSP2POLBATM
SCHEMBL4737221 0.86 USP2 (0.56) MEN1KMT2AUSP2POLBATM
SCHEMBL10167876 0.86 MEN1 (0.72) MEN1KMT2AUSP2POLBATM
SCHEMBL10030600 0.86 USP2 (0.64) MEN1KMT2AUSP2POLBATM
SCHEMBL12909304 0.86 USP2 (0.51) MEN1KMT2AUSP2POLBATM
SCHEMBL12909302 0.85 USP2 (0.53) MEN1KMT2AUSP2POLBATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11519014-B2 Specific substrate of an ALDH isoenzyme ADVANCED BIODESIGN (FR) 2022-12-06 US disclosed
US-11519014-B2 Specific substrate of an ALDH isoenzyme ADVANCED BIODESIGN (FR) 2022-12-06 US disclosed
US-20210017594-A1 METHODS FOR OBTAINING AND CORRECTING BIOLOGICAL SEQUENCE INFORMATION CYGNUS BIOSCIENCES (BEIJING) CO., LTD. (CN) 2021-01-21 US disclosed
US-20200407787-A1 METHODS FOR OBTAINING AND CORRECTING BIOLOGICAL SEQUENCE INFORMATION CYGNUS BIOSCIENCES (BEIJING) CO., LTD (CN) 2020-12-31 US disclosed
US-10738356-B2 Methods for obtaining and correcting biological sequence information CYGNUS BIOSCIENCES (BEIJING) CO., LTD. (CN) 2020-08-11 US disclosed
US-10370538-B2 Probes for rapid and specific detection of mycobacteria THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2019-08-06 US disclosed
US-20190233871-A1 SPECIFIC SUBSTRATE OF AN ALDH ISOENZYME ADVANCED BIODESIGN (FR) 2019-08-01 US disclosed
US-20190233871-A1 SPECIFIC SUBSTRATE OF AN ALDH ISOENZYME ADVANCED BIODESIGN (FR) 2019-08-01 US disclosed
EP-3491143-A1 SPECIFIC SUBSTRATE OF AN ALDH ISOENZYME Advanced Biodesign (FR) 2019-06-05 EP disclosed
US-20180305329-A1 XANTHINE COMPOUND AND USE THEREOF GORYO CHEMICAL, INC. (JP) 2018-10-25 US disclosed
US-7868147-B2 substantially no fluorescent before the cleavage but highly fluorescent after the cleavage; traps a target substance such as an enzyme and emits fluorescence Nagano, Tetsuo (JP) 2011-01-11 US disclosed
US-7868147-B2 substantially no fluorescent before the cleavage but highly fluorescent after the cleavage; traps a target substance such as an enzyme and emits fluorescence Nagano, Tetsuo (JP) 2011-01-11 US disclosed
US-7842823-B2 Fluorogenic probes for reactive oxygen species THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-11-30 US disclosed
US-20100297681-A1 FLUORESCENT PROBE FOR MEASUREMENT OF GLUCURONATE TRANSFERASE THE UNIVERSITY OF TOKYO (JP) 2010-11-25 US disclosed
US-20100297681-A1 FLUORESCENT PROBE FOR MEASUREMENT OF GLUCURONATE TRANSFERASE THE UNIVERSITY OF TOKYO (JP) 2010-11-25 US disclosed
US-7524974-B2 Fluorescent probe Nagano, Tetsuo (JP) 2009-04-28 US disclosed
US-7524974-B2 Fluorescent probe Nagano, Tetsuo (JP) 2009-04-28 US disclosed
US-20080014602-A1 Fluorescent Probe SEKISUI MEDICAL CO., LTD. (JP) 2008-01-17 US disclosed
US-20080014602-A1 Fluorescent Probe SEKISUI MEDICAL CO., LTD. (JP) 2008-01-17 US disclosed
US-20070141658-A1 Fluorogenic probes for reactive oxygen species THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-06-21 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 (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-20070141658-A1 Fluorogenic probes for reactive oxygen species PRDX1, GPX1, GPX4 MEN1 2037/4885KMT2A 4358/4885USP2 2291/4885
US-10370538-B2 Probes for rapid and specific detection of mycobacteria DPEP1, MRPL21, RCE1 MEN1 4202/4885KMT2A 4233/4885USP2 362/4885
US-20180305329-A1 XANTHINE COMPOUND AND USE THEREOF CYP3A43, CYP3A4, CYP1A1 MEN1 4859/4885KMT2A 4199/4885USP2 1995/4885

“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.