SCHEMBL3889538

SCHEMBL3889538

COC(=O)CCc1ccc(OC2Cc3ccccc3C2)c(-c2ccc3cnccc3c2)c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCNC P24863 6/20 0.52
CDK8 P49336 6/20 0.52
IKBKB O14920 4/20 0.40
CHUK O15111 4/20 0.40
NOX1 Q9Y5S8 1/20 0.40
PTPN1 P18031 2/20 0.39
FFAR4 Q5NUL3 2/20 0.39
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
LCK P06239 1/20 0.37
ROCK1 Q13464 1/20 0.37
HDAC1 Q13547 1/20 0.37
ROCK2 O75116 1/20 0.37
ABL1 P00519 1/20 0.36

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
SCHEMBL3880651 0.90 FFAR4 (0.50) CCNCCDK8IKBKBCHUKFFAR4
SCHEMBL3883470 0.88 CCNC (0.50) CCNCCDK8IKBKBCHUKFFAR4
SCHEMBL3887851 0.88 CCNC (0.49) CCNCCDK8IKBKBCHUKFFAR4
SCHEMBL3884038 0.84 TRPA1 (0.42) CCNCCDK8PTPN1PDE4APDE4B
SCHEMBL3884507 0.83 AR (0.41) CCNCCDK8PTPN1PDE4APDE4B
SCHEMBL3895963 0.82 IKBKB (0.42) IKBKBCHUKNOX1FFAR4PDE4A
SCHEMBL3880534 0.81 CACNA1H (0.38) CCNCCDK8NOX1PTPN1FFAR4
SCHEMBL3684452 0.80 CCNC (0.49) CCNCCDK8PTPN1FFAR4PDE4A
SCHEMBL3886842 0.79 CCNC (0.48) CCNCCDK8PTPN1FFAR4PDE4A
SCHEMBL3883590 0.78 FFAR4 (0.53) CCNCCDK8IKBKBCHUKFFAR4

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
EP-1477472-B1 SUBSTITUTED PHENYLALKANOIC ACID DERIVATIVE AND USE THEREOF ASAHI KASEI PHARMA CORP (JP) 2009-01-14 EP claimed
US-6867320-B2 Substituted phenylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2005-03-15 US claimed
EP-1477472-A1 SUBSTITUTED PHENYLALKANOIC ACID DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2004-11-17 EP claimed
US-20040044258-A1 Substituted phenylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2004-03-04 US claimed
EP-1477472-B1 SUBSTITUTED PHENYLALKANOIC ACID DERIVATIVE AND USE THEREOF ASAHI KASEI PHARMA CORP (JP) 2009-01-14 EP disclosed
US-6867320-B2 Substituted phenylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2005-03-15 US disclosed
EP-1477472-A1 SUBSTITUTED PHENYLALKANOIC ACID DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2004-11-17 EP disclosed
US-20040044258-A1 Substituted phenylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2004-03-04 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-20040044258-A1 Substituted phenylalkanoic acid derivatives and use thereof PTGER1, CYSLTR1, PTGS1 CCNC 2174/4885CDK8 3600/4885IKBKB 185/4885

“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.