SCHEMBL738322

SCHEMBL738322

C[Si](C)(CCCN1C(=O)C2CC=CCC2C1=O)O[Si](C)(C)CCCN1C(=O)C2CC=CCC2C1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
MEN1 O00255 1/20 0.41
ESR1 P03372 1/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
USP2 O75604 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
CA9 Q16790 1/20 0.40
TP53 P04637 1/20 0.39
ATM Q13315 1/20 0.39
LMNA P02545 1/20 0.39
HTR1A P08908 1/20 0.39
DRD2 P14416 1/20 0.39

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
SCHEMBL12977107 0.84 USP2 (0.41) ALDH1A1MEN1ESR1POLBHPGD
SCHEMBL740320 0.81 ALDH1A1 (0.33) ALDH1A1MEN1ESR1POLBHPGD
SCHEMBL21168596 0.77 ALDH1A1 (0.61) ALDH1A1MEN1ESR1POLBHPGD
SCHEMBL9179752 0.76 ALDH1A1 (0.47) ALDH1A1MEN1ESR1POLBHPGD
SCHEMBL13606476 0.76 SMN1; SMN2 (0.50) ALDH1A1MEN1ESR1POLBHPGD
SCHEMBL9179747 0.76 ALDH1A1 (0.47) ALDH1A1MEN1ESR1POLBHPGD
SCHEMBL17532418 0.75 ALDH1A1 (0.57) ALDH1A1MEN1ESR1POLBHPGD
SCHEMBL11860195 0.75 ALDH1A1 (0.50) ALDH1A1MEN1ESR1POLBHPGD
SCHEMBL7453826 0.73 KMT2A (0.53) ALDH1A1MEN1ESR1POLBHPGD
Ammonia Solution, Strong SCHEMBL9180826 0.73 ALDH1A1 (0.49) ALDH1A1MEN1ESR1POLBHPGD

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-8138296-B2 Epoxy compounds and process for their production SHOWA DENKO K.K. (JP) 2012-03-20 US disclosed
US-20090182110-A1 NOVEL EPOXY COMPOUNDS AND PROCESS FOR THEIR PRODUCTION SHOWA DENKO K.K. (JP) 2009-07-16 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-20090182110-A1 NOVEL EPOXY COMPOUNDS AND PROCESS FOR THEIR PRODUCTION ELOVL3, ACSL3, ACSL4 ALDH1A1 848/4885MEN1 3011/4885ESR1 88/4885

“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.