SCHEMBL5407527

SCHEMBL5407527

C=CCCCOc1ccc(C(=O)Cl)cc1

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.73
ALDH1A1 P00352 1/20 0.73
HTT P42858 2/20 0.49
GAA P10253 2/20 0.46
PKM P14618 1/20 0.42
MAPT P10636 1/20 0.42
LSS P48449 2/20 0.42
LMNA P02545 1/20 0.42
ESR1 P03372 1/20 0.42
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL8152256 0.95 L3MBTL1 (0.67) L3MBTL1ALDH1A1HTTGAAMAPT
SCHEMBL8379458 0.94 L3MBTL1 (0.65) L3MBTL1ALDH1A1HTTGAALSS
SCHEMBL10261955 0.94 L3MBTL1 (0.65) L3MBTL1ALDH1A1HTTGAALSS
SCHEMBL3229845 0.92 L3MBTL1 (0.61) L3MBTL1ALDH1A1HTTGAAPKM
SCHEMBL9145010 0.90 L3MBTL1 (0.60) L3MBTL1ALDH1A1HTTGAALSS
SCHEMBL4350348 0.85 ALDH1A1 (1.00) L3MBTL1ALDH1A1HTTPKMMAPT
SCHEMBL10261674 0.83 L3MBTL1 (0.73) L3MBTL1ALDH1A1HTTGAAMAPT
SCHEMBL5479108 0.83 L3MBTL1 (0.51) L3MBTL1ALDH1A1HTTGAAMAPT
SCHEMBL9615211 0.82 GAA (0.66) L3MBTL1HTTGAATP53TSHR
SCHEMBL13146702 0.82 L3MBTL1 (0.71) L3MBTL1ALDH1A1HTTGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7230123-B2 Ureido or carbamate derivatives of crown ethers and of silicon usable for preparing supports intended for the separation by chromatography of metal cations and of organic molecules comprising amine functional groups COMMISSARIAT A L'ENERGIR ATOMIQUE (FR) 2007-06-12 US disclosed
US-7067640-B1 Cross-linked chiral compounds and methods of making thereof EKA CHEMICALS AB (SE) 2006-06-27 US disclosed
US-20050143587-A1 Ureido or carbamate derivatives of crown ethers and of silicon usable for preparing supports intended for the separation by chromatography of metal cations and of organic molecules comprising amine functional groups COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2005-06-30 US disclosed
US-6342592-B1 FUNCTIONALIZED ALKENOXYARYL OR ALKENYLARYLOXYARYL COMPOUND; SEPARATING ENANTIOMORPHS USING THREE-DIMENSIONAL NETWORKS; CHROMATOGRAPHY INSTITUT FRANCAIS DU PETROLE AND CHIRALSEP (FR) 2002-01-29 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-20050143587-A1 Ureido or carbamate derivatives of crown ethers and of silicon usable for preparing supports intended for the separation by chromatography of metal cations and of organic molecules comprising amine functional groups UTS2R, SRM, SMOX L3MBTL1 4661/4885ALDH1A1 3701/4885HTT 4520/4885

“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.