SCHEMBL1708299

SCHEMBL1708299

Cc1nc2ccccn2c1-c1cccc(CNc2ccc3c(c2)OC[C@H]3CC(=O)O)c1C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 13/20 0.42
PPARD Q03181 7/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39
PPARG P37231 7/20 0.39
PPARA Q07869 2/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ROCK2 O75116 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
SCHEMBL1708612 0.92 SMN1; SMN2 (0.38) FFAR1PPARDSMN1; SMN2NPC1ALDH1A1
SCHEMBL10009390 0.90 FFAR1 (0.40) FFAR1PPARDPPARGPPARA
SCHEMBL1708301 0.85 SMN1; SMN2 (0.41) SMN1; SMN2NPC1ALDH1A1TP53RAB9A
SCHEMBL10291386 0.83 LMNA (0.35) FFAR1PPARDSMN1; SMN2NPC1ALDH1A1
SCHEMBL1708462 0.78 SMN1; SMN2 (0.37) SMN1; SMN2NPC1ALDH1A1TP53RAB9A
SCHEMBL1708346 0.78 FFAR1 (0.43) FFAR1PPARDPPARG
SCHEMBL10010387 0.77 FFAR1 (0.46) FFAR1PPARDPPARGPPARA
SCHEMBL10011340 0.77 FFAR1 (0.51) FFAR1PPARDPPARGPPARA
SCHEMBL1707920 0.77 FFAR1 (0.46) FFAR1PPARDPPARG
SCHEMBL1708294 0.77 FFAR1 (0.45) FFAR1PPARDPPARG

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-20120172351-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-07-05 US disclosed
EP-2440541-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2012-04-18 EP disclosed
WO-2010143733-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-16 WO 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-20120172351-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF GPR119, INSR, GLP1R FFAR1 20/4885PPARD 133/4885SMN1; SMN2 4287/4885

“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.