SCHEMBL3882968

SCHEMBL3882968

Cn1ccc2cc(-c3cc(CCC(=O)O)ccc3OCC3CCCCC3)ccc21

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.46
THRB P10828 1/20 0.46
S1PR1 P21453 1/20 0.42
FFAR4 Q5NUL3 3/20 0.42
CHRNA7 P36544 12/20 0.42
XDH P47989 1/20 0.39
C5AR1 P21730 1/20 0.38
FFAR1 O14842 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
SCHEMBL3884556 0.99 THRA (0.44) THRATHRBS1PR1FFAR4CHRNA7
SCHEMBL3885530 0.91 CHRNA7 (0.43) CHRNA7C5AR1
SCHEMBL3883669 0.90 CHRNA7 (0.44) CHRNA7C5AR1
SCHEMBL3883330 0.89 FFAR4 (0.45) THRATHRBS1PR1FFAR4FFAR1
SCHEMBL3881653 0.88 THRA (0.43) THRATHRBS1PR1FFAR4C5AR1
SCHEMBL3683810 0.88 FFAR4 (0.47) THRATHRBS1PR1FFAR4XDH
SCHEMBL3883706 0.88 THRA (0.42) THRATHRBS1PR1FFAR4C5AR1
SCHEMBL3881703 0.87 THRA (0.44) THRATHRBS1PR1FFAR4XDH
SCHEMBL3881230 0.87 THRA (0.44) THRATHRBS1PR1FFAR4XDH
SCHEMBL3883081 0.87 FFAR4 (0.45) THRATHRBS1PR1FFAR4CHRNA7

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 THRA 1720/4885THRB 3187/4885S1PR1 77/4885

“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.