SCHEMBL924970

SCHEMBL924970

CC(C)(C)N(CCCO)CCCO

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 2/20 0.30
HSD17B10 Q99714 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL23339267 0.95 ALDH1A1 (0.35) ALDH1A1MAPT
SCHEMBL23339269 0.90 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2LMNAHSD17B10MEN1
SCHEMBL27417047 0.88
SCHEMBL23338093 0.87 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2LMNAHSD17B10MEN1
SCHEMBL23338082 0.86 LMNA (0.50) ALDH1A1MAPTSMN1; SMN2LMNAHSD17B10
SCHEMBL23338088 0.86 LMNA (0.50) ALDH1A1MAPTSMN1; SMN2LMNAHSD17B10
SCHEMBL19766564 0.82 LCK (0.31) TSHR
SCHEMBL115482 0.81 MAPT (0.42) ALDH1A1MAPTSMN1; SMN2
SCHEMBL23338085 0.79 SMN1; SMN2 (0.38) ALDH1A1SMN1; SMN2LMNAHSD17B10MEN1
SCHEMBL7927876 0.79 ALDH1A1 (0.39) ALDH1A1MAPTSMN1; SMN2LMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230149369-A1 Compounds that Interact with the Ras Superfamily for the Treatment of Cancers, Inflammatory Diseases, Rasopathies, and Fibrotic Disease SHY Therapeutics LLC (US) 2023-05-18 US disclosed
EP-1741735-B1 ANTIOXIDANTS AND RECORDING MEDIA MADE BY USING THE SAME CANON FINETECH INC (JP) 2011-10-12 EP disclosed
US-7868121-B2 Antioxidants and recording media by using the same CANON FINETECH INC. (JP) 2011-01-11 US disclosed
US-20070273716-A1 Antioxidants And Recording Media By Using The Same CANON FINETECH NISCA INC. (JP) 2007-11-29 US disclosed
EP-1741735-A1 ANTIOXIDANTS AND RECORDING MEDIA MADE BY USING THE SAME Canon Finetech Inc. (JP) 2007-01-10 EP disclosed
US-5603760-A WITH OXYALKYLENE GLYCOLS, OXYALKYLENE ADDUCTS OF MONOALCOHOLS AND POLYOLS, AND AMMONIUM SALT(S) OF TALL OIL FATTY ACID, CONSTRUCTION MATERIAL WHICH MAINTAINS AIR ENTRAINMENT W. R. GRACE & CO.-CONN. (US) 1997-02-18 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-20230149369-A1 Compounds that Interact with the Ras Superfamily for the Treatment of Cancers, Inflammatory Diseases, Rasopathies, and Fibrotic Disease HRAS, KRAS, NRAS ALDH1A1 3448/4885MAPT 4169/4885SMN1; SMN2 3555/4885

“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.