SCHEMBL29829095

SCHEMBL29829095

O=C(O)Cc1cccc(O)c1O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.72
DUSP3 P51452 1/20 0.55
PTPN5 P54829 1/20 0.55
PTPN11 Q06124 1/20 0.55
CTDSP1 Q9GZU7 1/20 0.55
IAPP P10997 4/20 0.53
TDP1 Q9NUW8 3/20 0.52
ALDH1A1 P00352 2/20 0.51
RECQL P46063 2/20 0.51
KDM4E B2RXH2 2/20 0.51
MAPT P10636 2/20 0.51
MEN1 O00255 1/20 0.51
POLB P06746 1/20 0.51
GAA P10253 1/20 0.51
THRB P10828 1/20 0.51
DNMT1 P26358 1/20 0.51
CASP6 P55212 1/20 0.51
KMT2A Q03164 1/20 0.51
MCL1 Q07820 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL8791 1.00 AKR1B1 (0.72) AKR1B1DUSP3PTPN5PTPN11CTDSP1
Ethylenediamine SCHEMBL6041178 0.92 AKR1B1 (0.62) AKR1B1DUSP3PTPN5PTPN11CTDSP1
SCHEMBL7937087 0.89 AKR1B1 (0.67) AKR1B1DUSP3PTPN5PTPN11CTDSP1
SCHEMBL28717700 0.84 IAPP (0.56) AKR1B1IAPPTDP1ALDH1A1RECQL
SCHEMBL72309 0.84 AKR1B1 (1.00) AKR1B1DUSP3PTPN5PTPN11CTDSP1
SCHEMBL30449014 0.84 AKR1B1 (1.00) AKR1B1DUSP3PTPN5PTPN11CTDSP1
SCHEMBL6054330 0.83 IAPP (0.50) AKR1B1DUSP3PTPN5PTPN11CTDSP1
SCHEMBL30940438 0.82 AKR1B1 (0.58) AKR1B1DUSP3PTPN5PTPN11CTDSP1
SCHEMBL4284420 0.82 AKR1B1 (0.95) AKR1B1DUSP3PTPN5PTPN11CTDSP1
Ammonia Solution, Strong SCHEMBL10886656 0.82 AKR1B1 (0.95) AKR1B1DUSP3PTPN5PTPN11CTDSP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220274989-A9 Compositions and Methods of Using the Same for Treatment of Neurodegenerative and Mitochondrial Disease MITOKININ, INC. (US) 2022-09-01 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-20220274989-A9 Compositions and Methods of Using the Same for Treatment of Neurodegenerative and Mitochondrial Disease NLN, NME4, COQ8A AKR1B1 2371/4885DUSP3 3561/4885PTPN5 2286/4885

“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.