SCHEMBL4282159

SCHEMBL4282159

CC(C)CCOc1ccc(C(=O)c2ccc(OCC(C)C)c(C(C)C(=O)O)c2)c(O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.44
PTGS1 P23219 2/20 0.42
PTGS2 P35354 2/20 0.42
FOS P01100 2/20 0.42
JUN P05412 2/20 0.42
ELANE P08246 1/20 0.40
XDH P47989 1/20 0.39
SLC22A12 Q96S37 1/20 0.39
HPGD P15428 2/20 0.39
ALDH1A1 P00352 2/20 0.39
THRB P10828 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
LMNA P02545 2/20 0.38
HTT P42858 2/20 0.38
CYP1A2 P05177 1/20 0.38
PGR P06401 1/20 0.38
CYP2D6 P10635 1/20 0.38
SLC6A2 P23975 1/20 0.38
PDE4A P27815 1/20 0.38

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
SCHEMBL4282160 0.82 JUN (0.66) MAPK1FOSJUNELANEALDH1A1
SCHEMBL27718127 0.82 MAPK1 (0.42) MAPK1FOSJUNXDHSLC22A12
SCHEMBL4285838 0.78 JUN (0.52) MAPK1FOSJUNHPGDALDH1A1
SCHEMBL27697746 0.76 MAPK1 (0.44) MAPK1HPGDALDH1A1THRBTSHR
SCHEMBL27718181 0.74 LMNA (0.42) MAPK1FOSJUNHPGDALDH1A1
SCHEMBL4279563 0.74 JUN (0.76) MAPK1FOSJUNELANEXDH
SCHEMBL4291386 0.74 JUN (0.52) FOSJUNHPGDALDH1A1HSD17B10
SCHEMBL4279655 0.73 FOS (0.56) MAPK1FOSJUNALDH1A1THRB
SCHEMBL4289733 0.73 FOS (0.48) MAPK1FOSJUNLMNAHTT
SCHEMBL4286099 0.73 FOS (0.52) FOSJUNELANEXDHSLC22A12

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-20090118169-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL USE THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2009-05-07 US disclosed
CN-101284865-A Novel compound and medical use thereof TOYAMA CHEMICAL CO LTD (JP) 2008-10-15 CN disclosed
CN-100378063-C Novel compound and medical use thereof TOYAMA CHEMICAL CO LTD (JP) 2008-04-02 CN disclosed
US-7314888-B1 Compounds and medicinal use thereof TOYAMA CHEMICAL CO., LTD. (JP) 2008-01-01 US disclosed
CN-1325376-A Novel compound and medical use thereof TOYAMA CHEMICAL CO LTD (JP) 2001-12-05 CN 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 763/4885PTGS1 1429/4885PTGS2 2903/4885

“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.