SCHEMBL3882569

SCHEMBL3882569

Cc1ccc2cc(-c3cc(CCC(=O)O)ccc3OCC3CCCCC3)ccc2n1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 3/20 0.47
THRA P10827 1/20 0.47
THRB P10828 1/20 0.47
HCAR2 Q8TDS4 1/20 0.45
FFAR4 Q5NUL3 5/20 0.43
XDH P47989 3/20 0.41
S1PR3 Q99500 1/20 0.41
S1PR5 Q9H228 1/20 0.41
C5AR1 P21730 1/20 0.38
FFAR1 O14842 2/20 0.38
KCNH2 Q12809 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
PDE10A Q9Y233 1/20 0.38
BACE1 P56817 1/20 0.38
PPARD Q03181 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
SCHEMBL3882883 0.87 THRA (0.47) S1PR1THRATHRBFFAR4XDH
SCHEMBL3888439 0.85 FFAR4 (0.54) S1PR1THRATHRBFFAR4XDH
SCHEMBL3884521 0.85 THRA (0.48) S1PR1THRATHRBFFAR4FFAR1
SCHEMBL3885965 0.85 THRA (0.50) S1PR1THRATHRBHCAR2FFAR4
SCHEMBL3883274 0.84 FFAR4 (0.55) S1PR1THRATHRBFFAR4C5AR1
SCHEMBL3883134 0.84 FFAR4 (0.46) S1PR1THRATHRBFFAR4XDH
SCHEMBL3882697 0.84 THRA (0.49) S1PR1THRATHRBFFAR4XDH
SCHEMBL3884679 0.84 S1PR1 (0.49) S1PR1THRATHRBXDHS1PR3
SCHEMBL3679667 0.84 FFAR4 (0.49) S1PR1THRATHRBHCAR2FFAR4
SCHEMBL3890186 0.83 PPARD (0.49) S1PR1THRATHRBFFAR4FFAR1

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

“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.