SCHEMBL16319290

SCHEMBL16319290

CCOC(=O)CCc1ncnc(OCc2ccc(-c3cc(OC)ccc3F)c(CC(C)(C)C)n2)c1OC

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 10/20 0.49
BRD4 O60885 2/20 0.34
CYSLTR2 Q9NS75 2/20 0.33
CYSLTR1 Q9Y271 2/20 0.33
TSHR P16473 1/20 0.33
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
GRK6 P43250 1/20 0.32

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
SCHEMBL16318839 0.93 FFAR1 (0.49) FFAR1BRD4CYSLTR2CYSLTR1TSHR
SCHEMBL16318632 0.93 FFAR1 (0.49) FFAR1BRD4CYSLTR2CYSLTR1TSHR
SCHEMBL16319131 0.91 FFAR1 (0.55) FFAR1GRK6
SCHEMBL16318891 0.85 FFAR1 (0.56) FFAR1CYSLTR2CYSLTR1
SCHEMBL16318769 0.84 FFAR1 (0.55) FFAR1CYSLTR2CYSLTR1
SCHEMBL16319216 0.84 FFAR1 (0.53) FFAR1CYSLTR2CYSLTR1
SCHEMBL16319151 0.84 FFAR1 (0.55) FFAR1GRK6
SCHEMBL16319359 0.84 FFAR1 (0.52) FFAR1BRD4CYSLTR2CYSLTR1TSHR
SCHEMBL16319129 0.83 FFAR1 (0.54) FFAR1BRD4CYSLTR2CYSLTR1
SCHEMBL16319099 0.83 FFAR1 (0.56) FFAR1GRK6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9181186-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-11-10 US disclosed
US-20150045378-A1 AROMATIC RING COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-02-12 US disclosed
EP-2816032-A1 AROMATIC RING COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-12-24 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-20150045378-A1 AROMATIC RING COMPOUND GPR119, GPR27, GPR4 FFAR1 31/4885BRD4 351/4885CYSLTR2 455/4885

“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.