SCHEMBL3843060

SCHEMBL3843060

CC(C)(CCc1ccccc1N)[Si](C)(C)O[Si](C)(C)C(C)(C)CCc1ccccc1N

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.33
FDPS P14324 1/20 0.33
IDO1 P14902 2/20 0.32
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL1995927 0.76 SIGMAR1 (0.39) SIGMAR1FDPSALDH1A1
Hydrochloric Acid SCHEMBL1259956 0.74 SIGMAR1 (0.38) SIGMAR1FDPSIDO1ALDH1A1
SCHEMBL29823262 0.73 DUT (0.35) SIGMAR1FDPSIDO1ALDH1A1
SCHEMBL3843065 0.73 SIGMAR1 (0.33) SIGMAR1FDPSALDH1A1
SCHEMBL1474688 0.73 DUT (0.35) SIGMAR1FDPSIDO1ALDH1A1
SCHEMBL8069572 0.71 DUT (0.39) SIGMAR1FDPSIDO1
SCHEMBL3940682 0.69 BACE1 (0.44) FDPSIDO1ALDH1A1
SCHEMBL5417529 0.69 SIGMAR1 (0.35) SIGMAR1FDPS
SCHEMBL23159894 0.69 ALOX15 (0.47) SIGMAR1FDPSALDH1A1
SCHEMBL17778194 0.69 FDPS (0.39) SIGMAR1FDPSIDO1ALDH1A1

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-7550510-B2 Solid phase synthesis of arylretinamides WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2009-06-23 US disclosed
US-20040102650-A1 Solid phase synthesis of arylretinamides NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-05-27 US disclosed
US-6696606-B2 REACTING HEXACHLOROACETONE WITH TRIPHENYLPHOSPHINE; CHLORINATION OF RETINOIC ACID; THEN AROMATIC AMINE; ANTICANCER AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION 2004-02-24 US disclosed
US-20030105164-A1 Solid phase synthesis of arylretinamides NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2003-06-05 US disclosed
WO-2003003987-A2 SOLID PHASE SYNTHESIS OF ARYLRETINAMIDES THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2003-01-16 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 (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-20040102650-A1 Solid phase synthesis of arylretinamides RARA, LRAT, NR2E3 SIGMAR1 3864/4885FDPS 1566/4885IDO1 4530/4885
US-20030105164-A1 Solid phase synthesis of arylretinamides RARA, LRAT, NR2E3 SIGMAR1 3864/4885FDPS 1566/4885IDO1 4530/4885

“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.