SCHEMBL5838451

SCHEMBL5838451

Cc1c(OCc2ccccc2)cc(C(=O)O)cc1OCc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
MAPT P10636 1/20 0.61
MAPK1 P28482 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
RXRA P19793 3/20 0.60
RXRB P28702 2/20 0.60
RXRG P48443 1/20 0.60
MRGPRX4 Q96LA9 6/20 0.56
NR4A2 P43354 2/20 0.56
NR4A1 P22736 1/20 0.56
NR4A3 Q92570 1/20 0.56
HPGD P15428 2/20 0.54
PTGER1 P34995 1/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL12563268 0.92 RXRA (0.60) MEN1KMT2AMAPTMAPK1TDP1
SCHEMBL1936315 0.90 MRGPRX4 (0.64) MEN1KMT2ARXRARXRBRXRG
SCHEMBL1936167 0.90 MRGPRX4 (0.57) MEN1KMT2ARXRARXRBRXRG
SCHEMBL16015342 0.86 LMNA (0.67) MEN1KMT2AMAPTMAPK1TDP1
SCHEMBL793724 0.85 MEN1 (0.65) MEN1KMT2ARXRARXRBRXRG
SCHEMBL15369572 0.84 RXRA (0.58) MEN1KMT2ARXRARXRBRXRG
SCHEMBL28011313 0.84 MAPT (0.54) MEN1KMT2AMAPTMAPK1TDP1
SCHEMBL69666 0.84 RXRA (0.70) MEN1KMT2ARXRARXRBRXRG
SCHEMBL11762649 0.84 RXRA (0.61) MEN1KMT2ARXRARXRBRXRG
SCHEMBL642448 0.83 MEN1 (0.63) MEN1KMT2ARXRARXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2721000-A1 SYNTHETIC EPIGALLOCATECHIN GALLATE (EGCG) ANALOGS The Royal Institution for the Advancement of Learning / McGill University (CA) 2014-04-23 EP disclosed
WO-2012171114-A1 SYNTHETIC EPIGALLOCATECHIN GALLATE (EGCG) ANALOGS THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) 2012-12-20 WO disclosed
US-7122573-B2 Analogs of green tea polyphenols as chemotherapeutic and chemopreventive agents SRI INTERNATIONAL (US) 2006-10-17 US disclosed
US-7109236-B2 Analogs of green tea polyphenols as chemotherapeutic and chemopreventive agents SRI INTERNATIONAL (US) 2006-09-19 US disclosed
EP-1581512-A2 ANALOGS OF GREEN TEA POLYPHENOLS AS CHEMOTHERAPEUTIC AND CHEMOPREVENTIVE AGENTS SRI INTERNATIONAL (US) 2005-10-05 EP disclosed
US-20040192723-A1 Analogs of green tea polyphenols as chemotherapeutic and chemopreventive agents SRI INTERNATIONAL 2004-09-30 US disclosed
WO-2004052873-A9 ANALOGS OF GREEN TEA POLYPHENOLS AS CHEMOTHERAPEUTIC AND CHEMOPREVENTIVE AGENTS STANFORD RES INST INT (US) 2004-08-12 WO disclosed
WO-2004052873-A2 ANALOGS OF GREEN TEA POLYPHENOLS AS CHEMOTHERAPEUTIC AND CHEMOPREVENTIVE AGENTS SRI INTERNATIONAL (US) 2004-06-24 WO disclosed
US-20040110790-A1 Analogs of green tea polyphenols as chemotherapeutic and chemopreventive agents SRI INTERNATIONAL 2004-06-10 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 (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-20040192723-A1 Analogs of green tea polyphenols as chemotherapeutic and chemopreventive agents TEAD4, TEAD3, TEAD1 MEN1 3729/4885KMT2A 2705/4885MAPT 2442/4885
US-20040110790-A1 Analogs of green tea polyphenols as chemotherapeutic and chemopreventive agents TEAD4, TEAD3, TEAD1 MEN1 3729/4885KMT2A 2705/4885MAPT 2442/4885

“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.