SCHEMBL3498978

SCHEMBL3498978

O=C(O)Cc1ccc(OCc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.67
PPARD Q03181 5/20 0.62
PPARA Q07869 4/20 0.62
PPARG P37231 3/20 0.62
PTGDR2 Q9Y5Y4 2/20 0.60
FFAR1 O14842 3/20 0.60
HRH3 Q9Y5N1 1/20 0.59
MRGPRX4 Q96LA9 1/20 0.58
RXRA P19793 1/20 0.57
RXRB P28702 1/20 0.57
RXRG P48443 1/20 0.57

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
SCHEMBL23605980 0.88 PPARA (0.75) MAOBPPARDPPARAPPARGFFAR1
SCHEMBL4186 0.86 MAOB (0.74) MAOBPPARDPPARAPPARGPTGDR2
SCHEMBL8329343 0.85 LTA4H (0.60) PPARDPPARAPPARGFFAR1RXRA
SCHEMBL21991284 0.85 MAOB (0.63) MAOBPPARDPPARAPPARGFFAR1
SCHEMBL267205 0.85 RXRA (0.68) FFAR1RXRARXRBRXRG
SCHEMBL19951231 0.84 MAOB (0.76) MAOBPPARAMRGPRX4RXRARXRB
SCHEMBL21991486 0.84 MAOB (0.67) MAOBPPARDPPARAPPARGFFAR1
SCHEMBL6525591 0.84 MAOB (0.76) MAOBPPARAMRGPRX4RXRARXRB
SCHEMBL4759196 0.84 FFAR1 (0.77) MAOBPPARDPPARAPPARGPTGDR2
SCHEMBL1010424 0.84 MAOB (0.64) MAOBPPARDPPARAPPARGFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130737-A1 Regulating Agent of GPR34 Receptor Function TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-27 US disclosed
EP-1849465-A1 AGENT FOR CONTROLLING FUNCTION OF GPR34 RECEPTOR Takeda Pharmaceutical Company Limited (JP) 2007-10-31 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-20100130737-A1 Regulating Agent of GPR34 Receptor Function GPR34, GPR4, GPR6 MAOB 3606/4885PPARD 384/4885PPARA 463/4885

“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.