SCHEMBL2525773

SCHEMBL2525773

CC(C)(C)OC(=O)CNCC(O)c1ccc(OC(=O)Cc2cccc(F)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.42
CCNT1 O60563 1/20 0.39
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
VNN1 O95497 1/20 0.38
GRM5 P41594 1/20 0.38
ADRB3 P13945 3/20 0.37
KMT2A Q03164 1/20 0.36
FFAR1 O14842 1/20 0.36
HTRA1 Q92743 1/20 0.35
LMNA P02545 1/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
MAOB P27338 1/20 0.35

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
SCHEMBL2531906 0.90 ADRB3 (0.38) ADRB3FFAR1PPARGPPARAMAOB
SCHEMBL2526470 0.89 MEN1 (0.42) KMT2AMAOB
SCHEMBL2528740 0.88 CYP1A2 (0.38) CTSSCTSKADRB3PPARGPPARA
SCHEMBL2527514 0.88 PDGFRB (0.41) CTSKADRB3KMT2ALMNA
SCHEMBL2527517 0.88 LMNA (0.44) ADRB3LMNA
SCHEMBL2526373 0.88 KMT2A (0.49) ADRB3KMT2ALMNAPPARGPPARA
SCHEMBL2529623 0.88 ADRB3 (0.45) ADRB3KMT2APPARGPPARA
SCHEMBL2533454 0.88 VNN1 (0.43) VNN1ADRB3
SCHEMBL2530860 0.85 FFAR1 (0.39) ADRB3FFAR1MAOB
SCHEMBL2526478 0.84 PPARG (0.38) ADRB3PPARGPPARA

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-8039501-B2 Synephrine derivatives useful as anti-inflammatory agents UNIVERSITEIT GENT (BE) 2011-10-18 US disclosed
US-20090029999-A1 Synephrine derivatives useful as anti-inflammatory agents UNIVERSITEIT GENT (BE) 2009-01-29 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-20090029999-A1 Synephrine derivatives useful as anti-inflammatory agents HRH1, HRH3, HRH2 GPR119 147/4885CCNT1 1760/4885CTSS 1524/4885

“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.