SCHEMBL7791101

SCHEMBL7791101

Cc1cc(C)c(-n2c3ccccc3c3c(OCCCN4CCCCC4)nc(C)nc32)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 1/20 0.48
BCHE P06276 4/20 0.47
ACHE P22303 1/20 0.47
ABCB1 P08183 2/20 0.43
HTR1A P08908 1/20 0.43
HTR7 P34969 1/20 0.43
HRH3 Q9Y5N1 2/20 0.42
KCNH2 Q12809 1/20 0.41
KDM4E B2RXH2 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL7788172 0.81 CRHR1 (0.46) CRHR1BCHEACHEKDM4E
SCHEMBL7791822 0.79 CRHR1 (0.49) CRHR1BCHEACHE
SCHEMBL7791099 0.78 CRHR1 (0.43) CRHR1
SCHEMBL7788173 0.78 CRHR1 (0.47) CRHR1BCHE
SCHEMBL7677447 0.77 CRHR1 (0.53) CRHR1BCHEACHEABCB1KDM4E
SCHEMBL7676298 0.76 CRHR1 (0.48) CRHR1BCHEACHEABCB1KDM4E
SCHEMBL7684145 0.76 CRHR1 (0.54) CRHR1BCHEACHEABCB1KDM4E
SCHEMBL7681592 0.76 CRHR1 (0.58) CRHR1BCHEACHEABCB1KDM4E
SCHEMBL7680077 0.75 CRHR1 (0.57) CRHR1ABCB1
SCHEMBL7684260 0.75 CRHR1 (0.48) CRHR1ABCB1KDM4E

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 1 patent. 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

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 CRHR1 33/4885BCHE 2583/4885ACHE 2871/4885

“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.