SCHEMBL6525052

SCHEMBL6525052

O=C(c1ccc(-c2ccc(OC3CN(Cc4ccc(C(F)(F)F)cc4)C3)cn2)cc1F)N1CC(O)C1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 12/20 0.42
PRKAA2 P54646 1/20 0.42
ALOX5AP P20292 3/20 0.41
FEN1 P39748 3/20 0.41
ADRB2 P07550 1/20 0.41
MLNR O43193 1/20 0.40
CYP3A4 P08684 1/20 0.40
KCNH2 Q12809 1/20 0.39
MCHR1 Q99705 1/20 0.39

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
SCHEMBL3659573 0.92 ADRB2 (0.51) STAT3PRKAA2ALOX5APFEN1ADRB2
SCHEMBL6521689 0.92 ADRB2 (0.49) STAT3PRKAA2ALOX5APFEN1ADRB2
SCHEMBL12788271 0.91 STAT3 (0.44) STAT3PRKAA2ADRB2MLNRCYP3A4
SCHEMBL3658326 0.90 LIPG (0.45) STAT3PRKAA2ADRB2
SCHEMBL3662088 0.88 STAT3 (0.41) STAT3PRKAA2ADRB2
SCHEMBL3654712 0.85 GPR119 (0.40) STAT3PRKAA2ADRB2
SCHEMBL3801414 0.85 CHRM2 (0.41) STAT3PRKAA2MCHR1
SCHEMBL3805215 0.84 GPR119 (0.44) STAT3PRKAA2ADRB2MLNR
SCHEMBL3807842 0.84 CHRM2 (0.44) STAT3PRKAA2MCHR1
SCHEMBL3660709 0.83 ADRB2 (0.52) STAT3PRKAA2ADRB2MLNRCYP3A4

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 STAT3 1637/4885PRKAA2 2341/4885ALOX5AP 835/4885

“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.