SCHEMBL6657641

SCHEMBL6657641

Cc1ccncc1-n1ccc2cc(-c3ccc(F)cc3)ccc21

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 5/20 0.44
CYP11B2 P19099 5/20 0.44
CYP19A1 P11511 1/20 0.40
MAPT P10636 5/20 0.39
KCNH2 Q12809 1/20 0.39
MAPK14 Q16539 1/20 0.39
PDE10A Q9Y233 2/20 0.39
NR3C1 P04150 4/20 0.38
PGR P06401 1/20 0.37
SCN9A Q15858 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
SCHEMBL6845500 0.91 CYP11B1 (0.47) CYP11B1CYP11B2CYP19A1MAPT
SCHEMBL6663540 0.90 MAPT (0.44) CYP11B1CYP11B2CYP19A1MAPTMAPK14
SCHEMBL6658314 0.89 MAPT (0.44) CYP11B1CYP11B2MAPTNR3C1
SCHEMBL6654310 0.88 CYP11B1 (0.45) CYP11B1CYP11B2CYP19A1MAPT
SCHEMBL6656138 0.87 CYP19A1 (0.45) CYP11B1CYP11B2CYP19A1MAPTKCNH2
SCHEMBL6656027 0.86 CYP11B1 (0.42) CYP11B1CYP11B2CYP19A1KCNH2PDE10A
SCHEMBL6846121 0.86 CYP11B1 (0.45) CYP11B1CYP11B2CYP19A1MAPT
SCHEMBL6653590 0.85 CYP11B2 (0.49) CYP11B1CYP11B2CYP19A1MAPTPDE10A
SCHEMBL6660298 0.85 CYP11B2 (0.55) CYP11B1CYP11B2CYP19A1MAPT
SCHEMBL6847482 0.84 CYP11B1 (0.62) CYP11B1CYP11B2CYP19A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040236110-A1 Substituted 3-pyridyl indoles and indazoles as c17,20 lyase inhibitors BAYER PHARMACEUTICALS CORPORATION 2004-11-25 US disclosed
EP-1432698-A2 SUBSTITUTED 3-PYRIDYL INDOLES AND INDAZOLES AS C17,20 LYASE INHIBITORS Bayer Pharmaceuticals Corporation (US) 2004-06-30 EP disclosed
WO-2003027094-A2 SUBSTITUTED 3-PYRIDYL INDOLES AND INDAZOLES AS C17,20 LYASE INHIBITORS BAYER PHARMACEUTICALS CORPORATION (US) 2003-04-03 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-20040236110-A1 Substituted 3-pyridyl indoles and indazoles as c17,20 lyase inhibitors CYP17A1, IDO1, CYP21A2 CYP11B1 30/4885CYP11B2 53/4885CYP19A1 9/4885

“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.