SCHEMBL14280805

SCHEMBL14280805

CC(C)(C)OC(=O)NC1Cc2cccnc2N(Cc2ccc(F)cc2)C1=O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 6/20 0.42
RIPK1 Q13546 9/20 0.42
NPY1R P25929 1/20 0.40
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
CHRM1 P11229 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CNR1 P21554 1/20 0.37
CNR2 P34972 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
SCHEMBL8274287 0.88 RIPK1 (0.41) SCN9ARIPK1NPY1RCYP1A2CYP2C19
SCHEMBL8274769 0.86 SCN9A (0.43) SCN9ARIPK1NPY1RCYP1A2CYP2C19
SCHEMBL8273830 0.84 SCN9A (0.47) SCN9ARIPK1NPY1R
Hydrochloric Acid SCHEMBL4897081 0.82 CYP1A2 (0.44) RIPK1CYP1A2CYP2C19KMT2A
SCHEMBL8273819 0.82 RIPK1 (0.44) SCN9ARIPK1
SCHEMBL6762780 0.80 EPHX2 (0.43) SCN9ARIPK1KMT2AL3MBTL1
SCHEMBL4897407 0.77 CYP1A2 (0.39) RIPK1CYP1A2CYP2C19KMT2ACNR1
SCHEMBL4886164 0.76 MEN1 (0.39) RIPK1CYP1A2CYP2C19CHRM1KMT2A
SCHEMBL7416762 0.76 NPY1R (0.59) SCN9ANPY1RKMT2AL3MBTL1
SCHEMBL5132571 0.76 NPY1R (0.59) SCN9ANPY1RKMT2AL3MBTL1

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-20080009512-A1 Tetrahydroquinolones and Aza-Analogues Thereof for Use as Dpp-IV Inhibitors in the Treatment of Diabetes ASTRAZENECA AB (SE) 2008-01-10 US disclosed
US-20080009512-A1 Tetrahydroquinolones and Aza-Analogues Thereof for Use as Dpp-IV Inhibitors in the Treatment of Diabetes ASTRAZENECA AB (SE) 2008-01-10 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-20080009512-A1 Tetrahydroquinolones and Aza-Analogues Thereof for Use as Dpp-IV Inhibitors in the Treatment of Diabetes DPP4, DPP8, DPP3 SCN9A 718/4885RIPK1 3999/4885NPY1R 134/4885

“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.