SCHEMBL4277103

SCHEMBL4277103

CCOC(=O)CCc1cc(C(NS(C)(=O)=O)c2ccc(OCC(C)C)cc2OCC(C)C)ccc1OCC(C)C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FOS P01100 2/20 0.42
JUN P05412 2/20 0.42
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HIF1A Q16665 2/20 0.33
ACACB O00763 1/20 0.32

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
SCHEMBL4283810 0.89 FOS (0.54) FOSJUNSMN1; SMN2ACACB
SCHEMBL4280763 0.88 LMNA (0.45) FOSJUNCYP4F2CYP4A11SMN1; SMN2
SCHEMBL4280608 0.87 FOS (0.43) FOSJUNCYP4F2CYP4A11KDM4E
SCHEMBL4281117 0.83 FOS (0.46) FOSJUNCYP4F2CYP4A11KDM4E
SCHEMBL4421331 0.76 FOS (0.56) FOSJUNSMN1; SMN2LMNAACACB
SCHEMBL4278052 0.75 FOS (0.55) FOSJUNSMN1; SMN2LMNAACACB
SCHEMBL4276443 0.75 FOS (0.62) FOSJUNCYP4F2CYP4A11KDM4E
SCHEMBL4280879 0.73 FOS (0.62) FOSJUNCYP4F2CYP4A11KDM4E
SCHEMBL2969633 0.72 FOS (0.47) FOSJUNCYP4F2CYP4A11KDM4E
SCHEMBL4285091 0.72 FOS (0.61) FOSJUNALDH1A1SMN1; SMN2HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090118169-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL USE THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2009-05-07 US disclosed
US-7314888-B1 Compounds and medicinal use thereof TOYAMA CHEMICAL CO., LTD. (JP) 2008-01-01 US disclosed
EP-1127869-A1 NOVEL COMPOUNDS AND MEDICINAL USE THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2001-08-29 EP 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-20090118169-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL USE THEREOF SP1, AP1G1, AP1M1 FOS 63/4885JUN 20/4885CYP4F2 1309/4885

“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.