SCHEMBL17525544

SCHEMBL17525544

COCCOCCOCCOc1ccc(N)cc1OCCOCCOCCOC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.50
GAA P10253 4/20 0.50
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 3/20 0.50
HTT P42858 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
USP2 O75604 1/20 0.46
TP53 P04637 1/20 0.46
POLB P06746 1/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
ATM Q13315 1/20 0.46
MAPK1 P28482 2/20 0.42
TSHR P16473 1/20 0.42
L3MBTL1 Q9Y468 6/20 0.41
TDP1 Q9NUW8 1/20 0.41
NPC1 O15118 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
DCK P27707 2/20 0.39

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
SCHEMBL4061067 0.94 ALDH1A1 (0.55) MAPTGAAALDH1A1KDM4EHTT
SCHEMBL29736247 0.94 ALDH1A1 (0.55) MAPTGAAALDH1A1KDM4EHTT
SCHEMBL22099991 0.93 MAPT (0.60) MAPTGAAALDH1A1KDM4EHTT
SCHEMBL5793563 0.88 ALDH1A1 (0.45) MAPTGAAALDH1A1KDM4EHTT
SCHEMBL29835049 0.88 ALDH1A1 (0.45) MAPTGAAALDH1A1KDM4EHTT
SCHEMBL5793648 0.88 ALDH1A1 (0.45) MAPTGAAALDH1A1KDM4EHTT
SCHEMBL10187277 0.87 MAPT (0.66) MAPTGAAALDH1A1KDM4EHTT
SCHEMBL5649965 0.87 KDM4E (0.56) MAPTGAAALDH1A1KDM4EHTT
SCHEMBL12518428 0.85 KDM4E (0.42) MAPTGAAALDH1A1KDM4EHTT
SCHEMBL6275090 0.85 GAA (0.42) MAPTGAAALDH1A1KDM4EHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10727488-B2 Redox mediators for metal-sulfur batteries THE MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2020-07-28 US disclosed
US-20170222226-A1 REDOX MEDIATORS FOR METAL-SULFUR BATTERIES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2017-08-03 US disclosed
US-20170222226-A1 REDOX MEDIATORS FOR METAL-SULFUR BATTERIES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2017-08-03 US disclosed
WO-2016025467-A1 REDOX MEDIATORS FOR METAL-SULFUR BATTERIES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-02-18 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 (2 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-10727488-B2 Redox mediators for metal-sulfur batteries SQOR, NDUFS4, NDUFS3 MAPT 2769/4885GAA 3891/4885ALDH1A1 1024/4885
US-20170222226-A1 REDOX MEDIATORS FOR METAL-SULFUR BATTERIES SQOR, NDUFS4, NDUFS3 MAPT 2769/4885GAA 3891/4885ALDH1A1 1024/4885

“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.