SCHEMBL6663540

SCHEMBL6663540

Cc1ccncc1-n1ccc2ccc(-c3ccc(F)cc3)cc21

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.44
CYP19A1 P11511 1/20 0.42
HTR6 P50406 2/20 0.41
MAPK14 Q16539 1/20 0.39
PDE10A Q9Y233 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CDC7 O00311 1/20 0.38
CDK2 P24941 1/20 0.38
ROCK1 Q13464 1/20 0.38
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 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
SCHEMBL6659505 0.91 HTR6 (0.50) MAPTCYP19A1HTR6CDK2ROCK1
SCHEMBL6657641 0.90 CYP11B1 (0.44) MAPTCYP19A1MAPK14PDE10ACYP11B1
SCHEMBL6658554 0.87 CYP19A1 (0.48) MAPTCYP19A1HTR6PDE10AKDM4E
SCHEMBL6845462 0.85 MAPT (0.49) MAPTCYP19A1HTR6PDE10AKDM4E
SCHEMBL6840679 0.84 CYP11B1 (0.52) MAPTCYP19A1HTR6CYP11B1CYP11B2
SCHEMBL6846187 0.83 MAPT (0.40) MAPTCYP19A1CYP11B1CYP11B2
SCHEMBL6661324 0.81 HTR1D (0.46) MAPTCYP19A1HTR6CYP11B1CYP11B2
SCHEMBL6659317 0.81 CYP19A1 (0.45) MAPTCYP19A1HTR6KDM4ECDC7
SCHEMBL6845500 0.80 CYP11B1 (0.47) MAPTCYP19A1HTR6CYP11B1CYP11B2
SCHEMBL6658314 0.79 MAPT (0.44) MAPTCYP11B1CYP11B2

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 MAPT 1659/4885CYP19A1 9/4885HTR6 1791/4885

“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.