SCHEMBL15968518

SCHEMBL15968518

CC(Oc1ccc2nc(-c3ccc(OCc4ccccc4)c(F)c3)oc2c1)[C@H](C)NC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.42
PPARD Q03181 3/20 0.42
PPARA Q07869 1/20 0.42
CEPT1 Q9Y6K0 1/20 0.42
GPR119 Q8TDV5 6/20 0.41
MAPT P10636 1/20 0.41
HPSE Q9Y251 2/20 0.41
S1PR1 P21453 1/20 0.40
S1PR3 Q99500 1/20 0.40
S1PR5 Q9H228 1/20 0.40
LMNA P02545 1/20 0.40
F2RL3 Q96RI0 1/20 0.40
MAOA P21397 1/20 0.40
ERN1 O75460 1/20 0.40
VSIR Q9H7M9 1/20 0.39

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
SCHEMBL15968145 0.88 MAPT (0.44) FFAR1PPARDPPARACEPT1GPR119
SCHEMBL15968598 0.84 ACACB (0.48) FFAR1PPARDPPARAGPR119MAPT
SCHEMBL14908394 0.79 ACACA (0.54) GPR119F2RL3
SCHEMBL15968100 0.79 ACACB (0.49) FFAR1PPARDPPARACEPT1MAPT
SCHEMBL15968407 0.79 ESR1 (0.61) FFAR1PPARDPPARAERN1VSIR
SCHEMBL15968466 0.76 CEPT1 (0.43) FFAR1PPARDPPARACEPT1GPR119
SCHEMBL15969320 0.75 ACACB (0.56) FFAR1PPARDPPARAS1PR1S1PR3
SCHEMBL15968648 0.75 MAPT (0.41) FFAR1PPARDPPARACEPT1GPR119
SCHEMBL15968649 0.74 ACACA (0.51) GPR119MAPTF2RL3
SCHEMBL15968187 0.74 S1PR1 (0.41) FFAR1PPARDPPARAMAPTS1PR1

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-9133129-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-15 US disclosed
EP-2772485-A1 BICYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-09-03 EP disclosed
US-20140243310-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-08-28 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-20140243310-A1 BICYCLIC COMPOUND BICRA, NR3C2, CYP11B2 FFAR1 3706/4885PPARD 1446/4885PPARA 1747/4885

“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.