SCHEMBL3882142

SCHEMBL3882142

NCC(=O)Nc1ccc2cc(-c3cc(CCC(=O)O)ccc3OCC3CCCC3)ccc2c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 2/20 0.44
FFAR4 Q5NUL3 4/20 0.43
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
S1PR1 P21453 1/20 0.40
SRC P12931 2/20 0.39
FNTA P49354 1/20 0.39
FNTB P49356 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
P2RX4 Q99571 1/20 0.38
METAP2 P50579 1/20 0.37
FFAR1 O14842 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP1A2 P05177 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
SCHEMBL3681291 0.93 C5AR1 (0.46) C5AR1FFAR4THRATHRBS1PR1
SCHEMBL3883616 0.91 C5AR1 (0.48) C5AR1FFAR4THRATHRBS1PR1
SCHEMBL3888525 0.90 C5AR1 (0.45) C5AR1FFAR4THRATHRBS1PR1
SCHEMBL3882832 0.89 C5AR1 (0.46) C5AR1FFAR4THRATHRBS1PR1
SCHEMBL3883780 0.87 FFAR4 (0.46) C5AR1FFAR4THRATHRBS1PR1
SCHEMBL3675617 0.86 FFAR4 (0.43) C5AR1FFAR4THRATHRBS1PR1
SCHEMBL3887159 0.85 FFAR4 (0.44) C5AR1FFAR4THRATHRBS1PR1
SCHEMBL3682691 0.84 FFAR4 (0.48) C5AR1FFAR4THRATHRBS1PR1
SCHEMBL3682868 0.84 FFAR4 (0.43) C5AR1FFAR4THRATHRBS1PR1
SCHEMBL3883274 0.84 FFAR4 (0.55) C5AR1FFAR4THRATHRBS1PR1

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 C5AR1 282/4885FFAR4 115/4885THRA 1720/4885

“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.