SCHEMBL6520781

SCHEMBL6520781

Cc1cc(-c2ccc(OC3CN(Cc4ccc(C(F)(F)F)cc4)C3)cn2)ccc1C(=O)NC(C)C

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.41
STAT3 P40763 7/20 0.40
MDM2 Q00987 2/20 0.40
PARP1 P09874 1/20 0.39
ACACB O00763 2/20 0.39
PRKAA2 P54646 1/20 0.38
RORC P51449 1/20 0.38
AXL P30530 1/20 0.38
MERTK Q12866 1/20 0.38
CHRM4 P08173 1/20 0.38
HIF1A Q16665 2/20 0.38
EPAS1 Q99814 2/20 0.38

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 0.94 ALOX5AP (0.42) ADRB2STAT3MDM2PARP1ACACB
SCHEMBL6519844 0.94 ALOX5AP (0.42) ADRB2STAT3MDM2PARP1ACACB
SCHEMBL6519504 0.92 PARP1 (0.45) ADRB2STAT3PARP1PRKAA2CHRM4
SCHEMBL6524325 0.91 CHRM2 (0.41) ADRB2STAT3MDM2PARP1RORC
SCHEMBL6524323 0.91 CHRM2 (0.41) ADRB2STAT3MDM2PARP1RORC
SCHEMBL3711560 0.91 PARP1 (0.41) ADRB2STAT3PARP1PRKAA2CHRM4
SCHEMBL3659359 0.90 STAT3 (0.43) ADRB2STAT3PARP1PRKAA2HIF1A
SCHEMBL3659855 0.89 STAT3 (0.45) ADRB2STAT3PRKAA2
SCHEMBL12788268 0.89 CHRM4 (0.43) STAT3MDM2PARP1CHRM4
SCHEMBL6520829 0.89 STAT3 (0.42) ADRB2STAT3PARP1PRKAA2

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 4 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
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 ADRB2 126/4885STAT3 1637/4885MDM2 4467/4885

“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.