SCHEMBL6657585

SCHEMBL6657585

Fc1cccc(-c2ccc3c(ccn3-c3cccnc3)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 7/20 0.48
CYP11B1 P15538 6/20 0.47
MAPT P10636 7/20 0.43
GRIN1 Q05586 3/20 0.42
GRIN2B Q13224 3/20 0.42
CYP17A1 P05093 2/20 0.40
CYP1A2 P05177 1/20 0.40
METAP2 P50579 1/20 0.40
CYP19A1 P11511 1/20 0.40
CYP3A4 P08684 1/20 0.40
NTSR1 P30989 1/20 0.39

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
SCHEMBL6847800 0.92 CYP11B2 (0.51) CYP11B2CYP11B1MAPTCYP17A1CYP19A1
SCHEMBL6660867 0.90 MAPT (0.46) CYP11B2CYP11B1MAPTGRIN1GRIN2B
SCHEMBL6656090 0.89 CYP11B2 (0.50) CYP11B2CYP11B1MAPTCYP17A1CYP1A2
SCHEMBL6846125 0.88 CYP11B2 (0.59) CYP11B2CYP11B1MAPTCYP17A1CYP1A2
SCHEMBL6655119 0.86 CYP11B2 (0.51) CYP11B2CYP11B1CYP17A1CYP19A1CYP3A4
SCHEMBL6656915 0.84 CYP11B1 (0.50) CYP11B2CYP11B1MAPTGRIN1GRIN2B
SCHEMBL6657580 0.84 ROCK2 (0.48) CYP11B2CYP11B1MAPTGRIN1GRIN2B
SCHEMBL6966876 0.84 CYP11B2 (0.53) CYP11B2CYP11B1MAPTCYP17A1CYP19A1
SCHEMBL22515748 0.84 CYP11B2 (0.49) CYP11B2CYP11B1CYP17A1CYP19A1CYP3A4
SCHEMBL6658095 0.84 NR3C1 (0.50) CYP11B2CYP11B1GRIN1GRIN2B

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 CYP11B2 53/4885CYP11B1 30/4885MAPT 1659/4885

“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.