SCHEMBL3880452

SCHEMBL3880452

Cn1ncc2cc(-c3cc(CCC(=O)O)cc(F)c3OC3CCCC3)ccc21

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.44
THRB P10828 1/20 0.44
AR P10275 4/20 0.42
FFAR4 Q5NUL3 5/20 0.41
DRD4 P21917 2/20 0.40
SIGMAR1 Q99720 2/20 0.40
TMEM97 Q5BJF2 1/20 0.40
CACNA1H O95180 1/20 0.40
CCNC P24863 2/20 0.39
CDK8 P49336 2/20 0.39
KDM1A O60341 2/20 0.39
FASN P49327 2/20 0.39
LIPG Q9Y5X9 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
SCHEMBL3889221 0.99 THRA (0.46) THRATHRBARFFAR4DRD4
SCHEMBL3882157 0.91 CACNA1H (0.42) ARDRD4SIGMAR1TMEM97CACNA1H
SCHEMBL3682581 0.91 THRA (0.46) THRATHRBARFFAR4SIGMAR1
SCHEMBL3884457 0.90 THRA (0.43) THRATHRBFFAR4CACNA1H
SCHEMBL3883907 0.89 THRA (0.44) THRATHRBARFFAR4CCNC
SCHEMBL3884934 0.89 THRA (0.45) THRATHRBFFAR4CACNA1H
SCHEMBL3887872 0.89 AR (0.41) ARFFAR4DRD4SIGMAR1TMEM97
SCHEMBL3881782 0.89 THRA (0.46) THRATHRBARFFAR4CCNC
SCHEMBL3882153 0.87 LIPG (0.41) ARDRD4SIGMAR1TMEM97CACNA1H
SCHEMBL3881662 0.85 FFAR4 (0.47) THRATHRBFFAR4CACNA1HCCNC

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 3187/4885AR 630/4885

“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.