SCHEMBL3633254

SCHEMBL3633254

CCOC(=O)CCc1ccc(N(Cc2ccc(OC(C)C)c(-c3c(C)cc(O[Si](C)(C)C(C)(C)C)cc3C)c2)S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1F

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.33
LMNA P02545 4/20 0.33
NPSR1 Q6W5P4 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.32
ALDH1A1 P00352 3/20 0.32
MEN1 O00255 1/20 0.32
HSD11B1 P28845 1/20 0.32
DRD2 P14416 1/20 0.31
PPARG P37231 3/20 0.31
PPARD Q03181 3/20 0.31
PPARA Q07869 3/20 0.31
PTPN22 Q9Y2R2 1/20 0.30

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
SCHEMBL3628917 0.90 MAPT (0.35) MAPTLMNANPSR1KMT2APOLB
SCHEMBL3632025 0.87 FFAR1 (0.39) MAPTLMNANPSR1POLB
SCHEMBL3629718 0.86 FFAR1 (0.33) MAPTLMNANPSR1KMT2APOLB
SCHEMBL3631606 0.86 FFAR1 (0.40) MAPTLMNANPSR1KMT2APOLB
SCHEMBL3631605 0.86 FFAR1 (0.35) MAPTLMNANPSR1KMT2APOLB
SCHEMBL3624456 0.85 FFAR1 (0.34) MAPTLMNANPSR1KMT2APOLB
SCHEMBL3630601 0.84 FFAR1 (0.42) MAPTLMNANPSR1KMT2APOLB
SCHEMBL3630598 0.84 FFAR1 (0.37) MAPTLMNANPSR1KMT2APOLB
SCHEMBL3632704 0.81 FFAR1 (0.37) MAPTLMNANPSR1PTPN22
SCHEMBL5108274 0.79 FFAR1 (0.47) DRD2PPARGPPARDPPARA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7786165-B2 Aminophenylpropanoic acid derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-31 US disclosed
US-7786165-B2 Aminophenylpropanoic acid derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-31 US disclosed
US-20080269220-A1 Aminophenylpropanoic Acid Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-10-30 US disclosed
US-20080269220-A1 Aminophenylpropanoic Acid Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-10-30 US disclosed
EP-1726580-A1 AMINOPHENYLPROPANOIC ACID DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2006-11-29 EP 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-20080269220-A1 Aminophenylpropanoic Acid Derivative GPR119, GPR55, GPR65 MAPT 3293/4885LMNA 4270/4885NPSR1 195/4885

“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.