SCHEMBL6753175

SCHEMBL6753175

COc1cc(C(=O)O)c(C(=O)OCc2ccccc2)c(OC)c1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
PDE4B Q07343 2/20 0.50
PDE4D Q08499 2/20 0.50
PDE7A Q13946 1/20 0.50
PDE3A Q14432 1/20 0.50
PDE7B Q9NP56 1/20 0.50
PRKCZ Q05513 1/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
CTSV O60911 2/20 0.47
CTSL P07711 2/20 0.47
PDE4A P27815 1/20 0.47
PDE4C Q08493 1/20 0.47
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.45
TDP1 Q9NUW8 2/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
PKM P14618 2/20 0.44

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
SCHEMBL29048447 0.81 PDE4B (0.55) ALDH1A1PDE4BPDE4DPDE7APDE3A
SCHEMBL21501007 0.80 TDP1 (0.52) ALDH1A1PDE4BPDE4DPDE7APDE3A
SCHEMBL6515696 0.80 L3MBTL1 (0.52) ALDH1A1PDE7AKMT2AMEN1POLB
SCHEMBL13701209 0.79 HTT (0.67) ALDH1A1PDE4BPDE4DPDE7APDE3A
SCHEMBL17652833 0.78 PRKCZ (0.49) ALDH1A1PDE4BPDE4DPDE7APDE3A
SCHEMBL22080490 0.78 PKM (0.68) ALDH1A1PDE4BPDE4DPDE7APDE3A
SCHEMBL27638666 0.77 KMT2A (0.61) ALDH1A1PRKCZKMT2AMEN1POLB
SCHEMBL8911580 0.76 PKM (0.58) ALDH1A1POLBMAPTTDP1PKM
SCHEMBL17652769 0.75 PRKCZ (0.57) ALDH1A1PDE4BPDE4DPDE7APDE3A
SCHEMBL28209060 0.75 PKM (0.48) ALDH1A1POLBCTSVCTSLMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6702705-B1 Prodrugs activated by targeted catalytic proteins IGEN INTERNATIONAL, INC. 2004-03-09 US disclosed
US-20030096765-A1 Prodrugs activated by targeted catalytic proteins IGEN, INC. 2003-05-22 US disclosed
US-6258360-B1 BENZOATE CONJUGATES; ANTITUMOR AGENTS IGEN INTERNATIONAL, INC. 2001-07-10 US disclosed
EP-0746336-A1 PRODRUGS ACTIVATED BY TARGETED CATALYTIC PROTEINS IGEN, INC. (US) 1996-12-11 EP disclosed
EP-0746336-A4 PRODRUGS ACTIVATED BY TARGETED CATALYTIC PROTEINS IGEN INC (US) 1996-07-26 EP disclosed
WO-1993002703-A1 PRODRUGS ACTIVATED BY TARGETED CATALYTIC PROTEINS IGEN, INC. (US) 1993-02-18 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 (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-20030096765-A1 Prodrugs activated by targeted catalytic proteins DNPH1, DNPEP, PNP ALDH1A1 1885/4885PDE4B 2001/4885PDE4D 2151/4885

“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.