SCHEMBL2526415

SCHEMBL2526415

CC(C)(C)OC(=O)CNCC(O)c1ccc(OC(=O)Cc2ccc(Cl)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.49
CNR2 P34972 3/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
MAPT P10636 1/20 0.40
ADRB3 P13945 5/20 0.39
ALOX15 P16050 1/20 0.38
CA2 P00918 1/20 0.38
CA5A P35218 1/20 0.38
KLK7 P49862 3/20 0.38
ADRB1 P08588 2/20 0.38
CNR1 P21554 1/20 0.37

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
SCHEMBL2527446 0.93 PPARG (0.42) KMT2APPARGPPARAADRB3ALOX15
SCHEMBL2527546 0.90 TDP1 (0.47) KMT2ACNR2PPARGPPARAMAPT
SCHEMBL2528949 0.90 L3MBTL1 (0.42) KMT2ACNR2PPARGPPARAMAPT
SCHEMBL2526373 0.89 KMT2A (0.49) KMT2APPARGPPARAADRB3ALOX15
SCHEMBL2529206 0.89 PPARG (0.41) KMT2APPARGPPARAADRB3ALOX15
SCHEMBL2530994 0.89 PPARG (0.41) KMT2APPARGPPARAMAPTADRB3
SCHEMBL2529623 0.89 ADRB3 (0.45) KMT2APPARGPPARAADRB3ALOX15
SCHEMBL2530357 0.89 PLA2G1B (0.42) KMT2APPARGPPARAADRB3ADRB1
SCHEMBL2525539 0.88 ADRB3 (0.43) KMT2APPARGPPARAADRB3ALOX15
SCHEMBL2527783 0.88 PPARG (0.45) PPARGPPARAADRB3ALOX15

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 KMT2A 2317/4885CNR2 93/4885PPARG 1096/4885

“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.