SCHEMBL3145806

SCHEMBL3145806

CCc1cc(C)c2cc(Oc3ccc(C[C@H](F)C(=O)O)cc3Br)ccc2n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.37
SLC2A1 P11166 1/20 0.37
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
MAPT P10636 3/20 0.33
KDM4E B2RXH2 2/20 0.33
ADAM17 P78536 1/20 0.33
NR3C1 P04150 3/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 1/20 0.32
NR1I2 O75469 1/20 0.31
PPARG P37231 1/20 0.31
AGTR2 P50052 1/20 0.31
BLM P54132 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL3136450 0.89 THRA (0.38) FFAR1MAPTKDM4EPPARG
SCHEMBL3140915 0.81 THRA (0.38) FFAR1KDM4EPPARG
SCHEMBL3133494 0.74 THRA (0.38) FFAR1PPARG
SCHEMBL3137202 0.73 THRA (0.38) KDM4EMEN1KMT2AALDH1A1PPARG
SCHEMBL5077538 0.72 THRB (0.39)
SCHEMBL3131333 0.69 THRA (0.39) PPARG
SCHEMBL3141250 0.67 THRA (0.37) FFAR1PPARG
SCHEMBL3145813 0.67 THRA (0.52) FFAR1KDM4ENR3C1HPGD
SCHEMBL3141231 0.67 THRA (0.38) PPARG
SCHEMBL3133621 0.66 THRA (0.39) PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2010-01-07 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-20100004271-A1 HETEROCYCLIC COMPOUNDS AS AGANIST FOR THE THYROID RECEPTOR TSHR, GHSR, TRHR FFAR1 32/4885SLC2A1 1576/4885PDCD1 4653/4885

“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.