SCHEMBL7783167

SCHEMBL7783167

COc1cc(CC(=O)NCCNc2cc(C)nc3c2c2ccccc2n3-c2c(C)cc(C)cc2C)ccc1O

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.38
IARS1 P41252 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
MARS1 P56192 1/20 0.36
GAA P10253 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
SCHEMBL7783151 0.89 HSD17B10 (0.43) TP53MAPT
SCHEMBL7791789 0.82 MAPT (0.42) TP53MAPT
SCHEMBL7791093 0.82 CA1 (0.39) TP53MAPTIARS1CA1CA2
SCHEMBL7788159 0.76 NPY1R (0.52) TP53MAPTGAA
SCHEMBL7676276 0.75 CRHR1 (0.49) TP53
SCHEMBL7783147 0.74 CRHR1 (0.53) TP53
SCHEMBL7791107 0.74 SMPD1 (0.44) TP53MAPTGAA
SCHEMBL7792969 0.71 CRHR1 (0.45) MAPT
SCHEMBL7788156 0.69 CRHR1 (0.47) TP53
SCHEMBL6095720 0.68 L3MBTL1 (0.45) CA1CA2GAA

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-20010031758-A1 Substituted 9H-pyridino[2,3-b] indole and 9H-pyrimidino[4,5-b] indole derivatives: selective neuropeptide Y receptor ligands NEUROGEN CORPORATION 2001-10-18 US claimed
US-6221875-B1 TREATING FEEDING DISORDERS, OBESITY, BULIMIA NERVOSA OR HYPERTENSION IN A MAMMAL NEUROGEN CORPORATION 2001-04-24 US claimed
US-20010031758-A1 Substituted 9H-pyridino[2,3-b] indole and 9H-pyrimidino[4,5-b] indole derivatives: selective neuropeptide Y receptor ligands NEUROGEN CORPORATION 2001-10-18 US disclosed
US-6221875-B1 TREATING FEEDING DISORDERS, OBESITY, BULIMIA NERVOSA OR HYPERTENSION IN A MAMMAL NEUROGEN CORPORATION 2001-04-24 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-20010031758-A1 Substituted 9H-pyridino[2,3-b] indole and 9H-pyrimidino[4,5-b] indole derivatives: selective neuropeptide Y receptor ligands NPY1R, NPY2R, NPY5R TP53 4450/4885MAPT 3767/4885IARS1 890/4885

“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.