SCHEMBL5771218

SCHEMBL5771218

COC(=O)CCc1conc1-c1ccc(Cl)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.41
MIF P14174 1/20 0.38
MAPK1 P28482 1/20 0.37
GABRA5 P31644 5/20 0.37
CTSA P10619 3/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
CCNC P24863 1/20 0.36
CDK8 P49336 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
FFAR1 O14842 2/20 0.36
ABL1 P00519 1/20 0.36
SCN9A Q15858 1/20 0.35

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
SCHEMBL5773773 0.91 FFAR4 (0.43) FFAR4MIFGABRA5CTSAMEN1
SCHEMBL5772569 0.90 MAPT (0.46) FFAR4GABRA5MEN1MAPTKMT2A
SCHEMBL5773644 0.86 FFAR4 (0.48) FFAR4TRPV1FFAR1
SCHEMBL5771214 0.84 FFAR4 (0.39) FFAR4MIFMAPK1GABRA5CCNC
SCHEMBL5776310 0.83 FFAR4 (0.55) FFAR4GABRA5
SCHEMBL5776636 0.78 SIRT2 (0.37) FFAR4GABRA5TRPV1FFAR1ABL1
SCHEMBL5774132 0.78 KMO (0.36) MAPK1GABRA5TRPV1ABL1
SCHEMBL5773927 0.77 CCNC (0.41) MIFMAPK1MEN1KMT2ACCNC
SCHEMBL5777241 0.76 FFAR4 (0.51) FFAR4FFAR1
SCHEMBL5775477 0.74 RXRA (0.53) FFAR4FFAR1

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
US-20060084690-A1 Isoxazole derivatives MOMOSE YU 2006-04-20 US disclosed
US-7022725-B2 Isoxazole derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-04-04 US disclosed
US-20040048908-A1 Isoxazole derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-03-11 US disclosed
EP-1340749-A1 ISOXAZOLE DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2003-09-03 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 (2 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-20060084690-A1 Isoxazole derivatives INSR, GPR119, INSRR FFAR4 143/4885MIF 3361/4885MAPK1 1148/4885
US-20040048908-A1 Isoxazole derivatives GPR119, INSR, IRS1 FFAR4 145/4885MIF 3127/4885MAPK1 485/4885

“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.