SCHEMBL3545449

SCHEMBL3545449

O=C(c1ccc(O)cc1)c1cc(O)cc(O)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.75
LMNA P02545 2/20 0.75
MAPT P10636 2/20 0.75
ESR1 P03372 1/20 0.75
ESR2 Q92731 1/20 0.75
PKM P14618 1/20 0.75
HPGD P15428 1/20 0.75
SRD5A2 P31213 1/20 0.62
MAPK1 P28482 1/20 0.60
MMP2 P08253 1/20 0.59
MMP3 P08254 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.57
FASN P49327 1/20 0.56
MEN1 O00255 2/20 0.56
RAB9A P51151 2/20 0.56
KMT2A Q03164 2/20 0.56
POLB P06746 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
NQO2 P16083 2/20 0.52

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
SCHEMBL5712143 0.95 HTT (0.75) HTTLMNAMAPTESR1ESR2
SCHEMBL31574444 0.90 HTT (0.83) HTTLMNAMAPTESR1ESR2
SCHEMBL7939852 0.87 FASN (0.70) HTTLMNAMAPTESR1ESR2
SCHEMBL18423 0.87 LMNA (1.00) HTTLMNAMAPTESR1ESR2
SCHEMBL699850 0.87 LMNA (1.00) HTTLMNAMAPTESR1ESR2
SCHEMBL22336666 0.84 LTA4H (0.55) HTTLMNAMAPTESR1ESR2
Methane SCHEMBL6378712 0.84 LMNA (0.94) HTTLMNAMAPTESR1ESR2
SCHEMBL29056089 0.84 LMNA (0.94) HTTLMNAMAPTESR1ESR2
SCHEMBL7929114 0.84 LMNA (0.94) HTTLMNAMAPTESR1ESR2
Fluoride SCHEMBL16505425 0.84 LMNA (0.94) HTTLMNAMAPTESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7705188-B2 Structural modification of resveratrol: sodium resverastatin phosphate Arizona Board of Regents, a body corporate of the State of Arizona, Acting for and on Behalf of the Arizona State University (US) 2010-04-27 US disclosed
US-20050240062-A1 Structural modification of resveratrol: Sodium resverastatin phosphate NATIONAL INSTITUTES OF HEALTH 2005-10-27 US disclosed
WO-2003086414-A1 STRUCTURAL MODIFICATION OF RESVERATROL: SODIUM RESVERASTATIN PHOSPHATE ARIZONA BOARD OF REGENTS (US) 2003-10-23 WO disclosed
EP-0361119-B1 Process for the production of benzophenones BASF AG (DE) 1993-10-27 EP disclosed
EP-0361119-A1 Process for the production of benzophenones BASF Aktiengesellschaft (DE) 1990-04-04 EP 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-20050240062-A1 Structural modification of resveratrol: Sodium resverastatin phosphate PI4KB, HDAC4, PIK3CA HTT 3125/4885LMNA 1321/4885MAPT 1972/4885

“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.