SCHEMBL5520048

SCHEMBL5520048

CN(C)c1nc(N[C@H]2CC[C@@H](C(=O)NCc3ccc(C(F)(F)F)cc3)CC2)nc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.61
MCHR1 Q99705 16/20 0.61
ADRA2A P08913 15/20 0.61
NPY5R Q15761 3/20 0.52
HTR1A P08908 1/20 0.52
ADRA1A P35348 1/20 0.52
HRH1 P35367 1/20 0.52
HTR2B P41595 1/20 0.52

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
SCHEMBL5520050 1.00 EPHX2 (0.61) EPHX2MCHR1ADRA2ANPY5RHTR1A
SCHEMBL4208710 0.92 MCHR1 (0.62) EPHX2MCHR1ADRA2ANPY5RHTR1A
SCHEMBL4208712 0.92 MCHR1 (0.62) EPHX2MCHR1ADRA2ANPY5RHTR1A
SCHEMBL4028504 0.91 MCHR1 (0.59) EPHX2MCHR1ADRA2ANPY5RHTR1A
SCHEMBL4028510 0.91 MCHR1 (0.59) EPHX2MCHR1ADRA2ANPY5RHTR1A
SCHEMBL4037479 0.91 MCHR1 (0.68) EPHX2MCHR1ADRA2ANPY5RHTR1A
SCHEMBL4031789 0.91 MCHR1 (0.68) EPHX2MCHR1ADRA2ANPY5RHTR1A
SCHEMBL4346297 0.89 MCHR1 (0.59) EPHX2MCHR1ADRA2ANPY5RHTR1A
SCHEMBL5525752 0.89 MCHR1 (0.59) EPHX2MCHR1ADRA2ANPY5RHTR1A
SCHEMBL4030762 0.89 MCHR1 (0.55) EPHX2MCHR1ADRA2ANPY5RHTR1A

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-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof ARENA PHARMACEUTICALS, INC. 2007-01-11 US claimed
US-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof ARENA PHARMACEUTICALS, INC. 2007-01-11 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-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof MCHR1, GPR119, MCHR2 EPHX2 3017/4885MCHR1 1/4885ADRA2A 103/4885

“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.