SCHEMBL3885402

SCHEMBL3885402

CCOC(=O)Cn1ccc2cc(-c3cc(CCC(=O)OC)ccc3OCC3CCCC3)ccc21

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.37
HRH3 Q9Y5N1 2/20 0.36
FFAR4 Q5NUL3 1/20 0.36
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
S1PR1 P21453 1/20 0.36
PDE4B Q07343 3/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
P2RX3 P56373 1/20 0.35
PTPN1 P18031 2/20 0.34
PDE4A P27815 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
C5AR1 P21730 1/20 0.34

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
SCHEMBL3881933 0.88 FFAR4 (0.43) HRH3FFAR4KMT2AMEN1PTPN1
SCHEMBL3883669 0.86 CHRNA7 (0.44) HRH3KMT2AMEN1PTPN1C5AR1
SCHEMBL3885530 0.85 CHRNA7 (0.43) HRH3KMT2AMEN1PTPN1C5AR1
SCHEMBL3881703 0.85 THRA (0.44) FFAR4S1PR1KMT2A
SCHEMBL3885751 0.84 HRH3 (0.38) HRH3S1PR1KMT2AMEN1PTPN1
SCHEMBL3881653 0.84 THRA (0.43) FFAR4S1PR1PTGDR2C5AR1
SCHEMBL3886912 0.84 PTPN1 (0.38) HRH3KMT2AMEN1PTPN1C5AR1
SCHEMBL3883330 0.83 FFAR4 (0.45) HRH3FFAR4S1PR1P2RX3PTGDR2
SCHEMBL3882068 0.81 FFAR4 (0.47) FFAR4S1PR1
SCHEMBL3882775 0.81 ELANE (0.42) HRH3S1PR1PDE4BKMT2AMEN1

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 4 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 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 ATM 2797/4885HRH3 533/4885FFAR4 115/4885

“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.