SCHEMBL3550962

SCHEMBL3550962

COc1cc(OC)cc(C(=O)c2ccc(O[Si](C)(C)C(C)(C)C)cc2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPT P10636 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
RXFP1 Q9HBX9 2/20 0.49
RAB9A P51151 2/20 0.49
LMNA P02545 1/20 0.49
MAPK1 P28482 1/20 0.49
TUBB1 Q9H4B7 2/20 0.48
TUBB4A P04350 1/20 0.48
TUBB P07437 1/20 0.48
TUBA3C P0DPH7 1/20 0.48
TUBA1B P68363 1/20 0.48
TUBA4A P68366 1/20 0.48
TUBB4B P68371 1/20 0.48
TUBB3 Q13509 1/20 0.48
TUBB2A Q13885 1/20 0.48
TUBB8 Q3ZCM7 1/20 0.48
TUBA3E Q6PEY2 1/20 0.48
TUBA1A Q71U36 1/20 0.48

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
SCHEMBL2500559 0.87 ELANE (0.52) MEN1KMT2AMAPTNPSR1RXFP1
SCHEMBL4823248 0.83 ALDH1A1 (0.55) LMNATUBB1TUBB4ATUBBTUBA3C
SCHEMBL4819801 0.83 ALDH1A1 (0.55) LMNATUBB1TUBB4ATUBBTUBA3C
SCHEMBL20364920 0.81 LMNA (0.53) MEN1KMT2AMAPTNPSR1RXFP1
SCHEMBL5280416 0.81 ELANE (0.57) ALDH1A1GAAPREPELANESTS
SCHEMBL3545138 0.81 TUBB4A (0.68) MEN1KMT2AMAPTNPSR1RXFP1
SCHEMBL25665190 0.80 RXRA (0.46) LMNAGAACA2
SCHEMBL7012599 0.78 PREP (0.43) MEN1KMT2AMAPTNPSR1RXFP1
SCHEMBL3057447 0.77 CA1 (0.50) MEN1KMT2AMAPTNPSR1RAB9A
SCHEMBL2912460 0.77 ALDH1A1 (0.50) MEN1KMT2ANPSR1RAB9AALDH1A1

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 2 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

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 MEN1 1644/4885KMT2A 1098/4885MAPT 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.