SCHEMBL4281226

SCHEMBL4281226

CC(C)CCOc1ccc(/C(=N\O)c2ccc(OCCC(C)C)c(OCCC(C)C)c2)cc1CC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.42
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
PLA2G2D Q9UNK4 1/20 0.38
XDH P47989 2/20 0.38
FOS P01100 2/20 0.38
JUN P05412 2/20 0.38
POLB P06746 2/20 0.37
HTT P42858 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
XBP1 P17861 1/20 0.37
CASP6 P55212 1/20 0.37
HSD17B10 Q99714 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HIF1A Q16665 1/20 0.36
LTB4R Q15722 1/20 0.35

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
SCHEMBL4281229 1.00 MAPK1 (0.42) MAPK1THRATHRBPLA2G2DXDH
SCHEMBL4279615 0.89 CYP19A1 (0.41) MAPK1PLA2G2DXDHPOLBHTT
SCHEMBL4279617 0.89 CYP19A1 (0.41) MAPK1PLA2G2DXDHPOLBHTT
SCHEMBL4853208 0.88 FOS (0.48) MAPK1THRATHRBPLA2G2DXDH
SCHEMBL4280876 0.78 THRA (0.47) MAPK1THRATHRBXDHHTT
SCHEMBL4276633 0.77 MAPK1 (0.64) MAPK1XDHPOLBHTTCASP6
SCHEMBL4277956 0.76 CYP19A1 (0.44) MAPK1PLA2G2DXDHFOSJUN
SCHEMBL4276406 0.76 ALDH1A1 (0.43) MAPK1THRATHRBPLA2G2DFOS
SCHEMBL4276411 0.76 ALDH1A1 (0.43) MAPK1THRATHRBPLA2G2DFOS
SCHEMBL4289851 0.74 LMNA (0.46) MAPK1THRATHRBXDHFOS

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 MAPK1 763/4885THRA 4138/4885THRB 3521/4885

“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.