SCHEMBL6519844

SCHEMBL6519844

Cc1cc(-c2ccc(OC3CN(Cc4ccc(C(F)(F)F)cc4)C3)cn2)ccc1C(=O)N[C@H](C)CO

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.42
FEN1 P39748 2/20 0.42
STAT3 P40763 7/20 0.39
HDAC4 P56524 1/20 0.38
PARP1 P09874 1/20 0.37
MDM2 Q00987 2/20 0.37
ACACB O00763 1/20 0.37
ADRB2 P07550 1/20 0.37
PRKAA2 P54646 1/20 0.37
SSTR5 P35346 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36

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
SCHEMBL6517503 1.00 ALOX5AP (0.42) ALOX5APFEN1STAT3HDAC4PARP1
SCHEMBL6520781 0.94 ADRB2 (0.41) STAT3PARP1MDM2ACACBADRB2
SCHEMBL6519504 0.89 PARP1 (0.45) STAT3PARP1ADRB2PRKAA2
SCHEMBL6524325 0.88 CHRM2 (0.41) STAT3PARP1MDM2ADRB2
SCHEMBL6524323 0.88 CHRM2 (0.41) STAT3PARP1MDM2ADRB2
SCHEMBL12788268 0.88 CHRM4 (0.43) STAT3PARP1MDM2SSTR5
SCHEMBL3711560 0.88 PARP1 (0.41) STAT3PARP1ADRB2PRKAA2SSTR5
SCHEMBL3659359 0.87 STAT3 (0.43) STAT3PARP1ADRB2PRKAA2
SCHEMBL3659855 0.87 STAT3 (0.45) STAT3ADRB2PRKAA2
SCHEMBL6520829 0.86 STAT3 (0.42) STAT3PARP1ADRB2PRKAA2

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-20110059942-A1 Azetidinyl G-Protein Coupled Receptor Agonists PROSIDION LIMITED (GB) 2011-03-10 US disclosed
US-20110059942-A1 Azetidinyl G-Protein Coupled Receptor Agonists PROSIDION LIMITED (GB) 2011-03-10 US disclosed
WO-2009050522-A1 AZETIDINYL G-PROTEIN COUPLED RECEPTOR AGONISTS PROSIDION LIMITED (GB) 2009-04-23 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-20110059942-A1 Azetidinyl G-Protein Coupled Receptor Agonists GPR119, GIPR, GPR39 ALOX5AP 835/4885FEN1 4871/4885STAT3 1637/4885

“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.