SCHEMBL2501544

SCHEMBL2501544

CCC(c1ccc(N(CC)CC)cc1O)c1ccc(N(CC)CC)cc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.47
MAPT P10636 12/20 0.47
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
KDM4E B2RXH2 5/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
CYP3A4 P08684 1/20 0.46
GAA P10253 6/20 0.46
HTT P42858 3/20 0.46
MAPK1 P28482 1/20 0.46
LMNA P02545 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
CRHBP P24387 1/20 0.45
CRHR2 Q13324 1/20 0.45
NPSR1 Q6W5P4 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
HPGD P15428 2/20 0.43
GRK6 P43250 1/20 0.43

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
SCHEMBL15488863 0.92 ALDH1A1 (0.47) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL10153005 0.84 LMNA (0.50) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL8172446 0.80 S100B (0.55) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL13296552 0.79 ALDH1A1 (0.47) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL3825700 0.79 MAPT (0.48) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL24227146 0.78 ALDH1A1 (0.42) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL5377820 0.78 ALDH1A1 (0.42) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL9363333 0.78 ALDH1A1 (0.47) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL10020928 0.78 ALDH1A1 (0.49) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL8179168 0.76 ALDH1A1 (0.54) ALDH1A1MAPTMEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4327874-A2 3,6-DISUBSTITUTED XANTHYLIUM SALTS WisTa Laboratories Ltd. (SG) 2024-02-28 EP disclosed
EP-4327874-A2 3,6-DISUBSTITUTED XANTHYLIUM SALTS WisTa Laboratories Ltd. (SG) 2024-02-28 EP disclosed
EP-3689346-B1 3,6-DISUBSTITUTED XANTHYLIUM SALTS FOR TREATING TAUOPATHIES WISTA LAB LTD (SG) 2024-01-24 EP disclosed
EP-3689346-B1 3,6-DISUBSTITUTED XANTHYLIUM SALTS FOR TREATING TAUOPATHIES WISTA LAB LTD (SG) 2024-01-24 EP disclosed
EP-3689346-A1 3,6-DISUBSTITUTED XANTHYLIUM SALTS WisTa Laboratories Ltd. (SG) 2020-08-05 EP disclosed
EP-3112358-B1 3,6-DISUBSTITUTED XANTHYLIUM SALTS WISTA LAB LTD (SG) 2020-04-29 EP disclosed
US-10399955-B2 3,6-disubstituted xanthylium salts WISTA LABORATORIES LTD. (SG) 2019-09-03 US disclosed
US-10399955-B2 3,6-disubstituted xanthylium salts WISTA LABORATORIES LTD. (SG) 2019-09-03 US disclosed
US-20170088534-A1 3,6-DISUBSTITUTED XANTHYLIUM SALTS WISTA LABORATORIES LTD. (SG) 2017-03-30 US disclosed
US-20170088534-A1 3,6-DISUBSTITUTED XANTHYLIUM SALTS WISTA LABORATORIES LTD. (SG) 2017-03-30 US disclosed
EP-3112358-A2 3,6-DISUBSTITUTED XANTHYLIUM SALTS WisTa Laboratories Ltd. (SG) 2017-01-04 EP disclosed
EP-2373660-B1 3,6-DISUBSTITUTED XANTHYLIUM SALTS AS MEDICAMENTS WISTA LAB LTD (SG) 2016-08-17 EP disclosed
EP-2373660-B1 3,6-DISUBSTITUTED XANTHYLIUM SALTS AS MEDICAMENTS WISTA LAB LTD (SG) 2016-08-17 EP disclosed
US-20140161731-A1 3,6-DISUBSTITUTED XANTHYLIUM SALTS WISTA LABORATORIES LTD. (SG) 2014-06-12 US disclosed
US-8658665-B2 3,6-disubstituted xanthylium salts and use thereof in treatment of tauopathies WISTA LABORATORIES LTD. (SG) 2014-02-25 US disclosed
CN-102307878-A 3, 6-disubstituted xanthylium salts WISTA LAB LTD 2012-01-04 CN disclosed
US-20110300074-A1 3,6-DISUBSTITUTED XANTHYLIUM SALTS WISTA LABORATORIES LTD. (SG) 2011-12-08 US disclosed
EP-2373660-A2 3,6-DISUBSTITUTED XANTHYLIUM SALTS AS MEDICAMENTS Wista Laboratories Ltd. (SG) 2011-10-12 EP disclosed
WO-2010067078-A2 3,6-DISUBSTITUTED XANTHYLIUM SALTS AS MEDICAMENTS WISTA LABORATORIES LTD. (SG) 2010-06-17 WO disclosed
WO-2010067078-A2 3,6-DISUBSTITUTED XANTHYLIUM SALTS AS MEDICAMENTS WISTA LABORATORIES LTD. (SG) 2010-06-17 WO 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 (4 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-20140161731-A1 3,6-DISUBSTITUTED XANTHYLIUM SALTS MAPT, PSEN2, PSEN1 ALDH1A1 4669/4885MAPT 1/4885MEN1 2597/4885
US-10399955-B2 3,6-disubstituted xanthylium salts MAPT, PSEN2, PSEN1 ALDH1A1 4669/4885MAPT 1/4885MEN1 2597/4885
US-20170088534-A1 3,6-DISUBSTITUTED XANTHYLIUM SALTS MAPT, PSEN2, PSEN1 ALDH1A1 4669/4885MAPT 1/4885MEN1 2597/4885
US-20110300074-A1 3,6-DISUBSTITUTED XANTHYLIUM SALTS MAPT, PSEN2, PSEN1 ALDH1A1 3541/4885MAPT 1/4885MEN1 900/4885

“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.