SCHEMBL3882041

SCHEMBL3882041

COC(=O)CCc1ccc(OCCc2cccc(F)c2)c(-c2ccc3ccccc3c2)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CCNC P24863 1/20 0.47
▸ CDK8 P49336 1/20 0.47
▸ PTPN1 P18031 2/20 0.42
▸ CNR2 P34972 2/20 0.42
▸ FFAR4 Q5NUL3 2/20 0.42
▸ SIRT2 Q8IXJ6 2/20 0.41
▸ TP53 P04637 2/20 0.40
▸ MDM2 Q00987 2/20 0.40
▸ AKR1C3 P42330 2/20 0.39
▸ C5AR1 P21730 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CNR1 P21554 1/20 0.39

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
SCHEMBL3892361 0.93 CCNC (0.49) CCNCCDK8PTPN1CNR2FFAR4
SCHEMBL3881188 0.92 CCNC (0.47) CCNCCDK8TP53MDM2AKR1C3
SCHEMBL3892073 0.91 CCNC (0.51) CCNCCDK8PTPN1CNR2FFAR4
SCHEMBL3882226 0.89 FFAR4 (0.53) CCNCCDK8FFAR4TP53MDM2
SCHEMBL3882028 0.87 CCNC (0.49) CCNCCDK8PTPN1FFAR4TP53
SCHEMBL3894129 0.86 CCNC (0.49) CCNCCDK8PTPN1FFAR4SIRT2
SCHEMBL3894136 0.85 CCNC (0.51) CCNCCDK8PTPN1CNR2FFAR4
SCHEMBL3887117 0.84 CCNC (0.52) CCNCCDK8PTPN1FFAR4C5AR1
SCHEMBL3685294 0.83 CCNC (0.48) CCNCCDK8PTPN1FFAR4SIRT2
SCHEMBL3882480 0.83 CCNC (0.46) CCNCCDK8PTPN1FFAR4MEN1

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 3600/4885PTPN1 1292/4885

“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.

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