SCHEMBL3337422

SCHEMBL3337422

[CH2]CCCC(C)CCCC(C)C

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.68
BLM P54132 1/20 0.48
MEN1 O00255 1/20 0.47
CYP3A4 P08684 1/20 0.47
ALOX15 P16050 1/20 0.47
KMT2A Q03164 1/20 0.47
PTPN1 P18031 3/20 0.42
PTPN2 P17706 1/20 0.32
CDC25B P30305 1/20 0.32
FNTA P49354 1/20 0.31
PGGT1B P53609 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
SCHEMBL10945252 0.92 LMNA (0.74) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL7269036 0.92 LMNA (0.74) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL27560161 0.90 LMNA (0.70) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL10953541 0.90 LMNA (0.70) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL386229 0.89 LMNA (0.68) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL238312 0.89 LMNA (0.68) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL1193294 0.89 LMNA (0.68) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL26304 0.88
SCHEMBL1506323 0.88 LMNA (0.47) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL23673156 0.86 LMNA (0.65) LMNABLMMEN1CYP3A4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220403289-A1 ALPHA-HYDROXYISOBUTYRIC ACID ESTER COMPOUND AND FRAGRANCE COMPOSITION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2022-12-22 US disclosed
CN-114867829-A Alpha-hydroxyisobutyrate compound and perfume composition 三菱瓦斯化学株式会社 2022-08-05 CN disclosed
US-20220002229-A1 DIGLYCOLAMIDE DERIVATIVES FOR SEPARATION AND RECOVERY OF RARE EARTH ELEMENTS FROM AQUEOUS SOLUTIONS UT-BATTELLE, LLC 2022-01-06 US disclosed
US-20220002840-A1 METHODS FOR SEPARATION AND RECOVERY OF RARE EARTH ELEMENTS FROM AQUEOUS SOLUTIONS USING DIGLYCOLAMIDE DERIVATIVES BATTELLE ENERGY ALLIANCE, LLC 2022-01-06 US disclosed
WO-2021132214-A1 α-HYDROXYISOBUTYRIC ACID ESTER COMPOUND AND FRAGRANCE COMPOSITION 三菱瓦斯化学株式会社 2021-07-01 WO disclosed
US-20100143273-A1 COSMETIC COMPOSITION COMPRISING AT LEAST ONE APROTIC HYDROCARBON-BASED VOLATILE SOLVENT L'OREAL S.A. (FR) 2010-06-10 US disclosed
EP-2083789-A1 COSMETIC COMPOSITION COMPRISING AT LEAST ONE APROTIC HYDROCARBON-BASED VOLATILE SOLVENT L'Oréal (FR) 2009-08-05 EP disclosed
WO-2008061985-A1 COSMETIC COMPOSITION COMPRISING AT LEAST ONE APROTIC HYDROCARBON-BASED VOLATILE SOLVENT L'OREAL (FR) 2008-05-29 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-20220403289-A1 ALPHA-HYDROXYISOBUTYRIC ACID ESTER COMPOUND AND FRAGRANCE COMPOSITION CYP8B1, HCAR1, GABRB1 LMNA 2520/4885BLM 4626/4885MEN1 1266/4885
US-20220002229-A1 DIGLYCOLAMIDE DERIVATIVES FOR SEPARATION AND RECOVERY OF RARE EARTH ELEMENTS FROM AQUEOUS SOLUTIONS GNE, GALE, ARGLU1 LMNA 3366/4885BLM 905/4885MEN1 2159/4885

“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.