SCHEMBL6846202

SCHEMBL6846202

Clc1ccccc1-n1ccc2ccc(-c3cccnc3)cc21

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 1/20 0.49
CYP11B1 P15538 8/20 0.49
CYP11B2 P19099 8/20 0.49
CYP19A1 P11511 5/20 0.49
CYP17A1 P05093 3/20 0.49
FGFR1 P11362 1/20 0.44
CAPN1 P07384 1/20 0.44
DOT1L Q8TEK3 2/20 0.43
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
MAPT P10636 1/20 0.40
CYP2A6 P11509 1/20 0.40
PTGES O14684 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
HTR6 P50406 1/20 0.40

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
SCHEMBL6659873 0.90 CYP11B2 (0.52) HTR1DCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL6844241 0.81 CYP11B2 (0.49) HTR1DCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL6846150 0.81 HTR1D (0.55) HTR1DCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL6845970 0.79 HTR1D (0.48) HTR1DCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL6846114 0.77 HTR1D (0.48) HTR1DCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL6658140 0.75 CYP19A1 (0.55) HTR1DCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL6657245 0.74 CYP11B2 (0.52) HTR1DCYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL5661564 0.74 DOT1L (0.52) CYP19A1DOT1LCYP2A6
SCHEMBL6659366 0.73 CYP19A1 (0.47) CYP11B1CYP11B2CYP19A1DOT1LMAPT
SCHEMBL6845513 0.72 CYP11B2 (0.49) HTR1DCYP11B1CYP11B2CYP19A1CYP17A1

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-20040236110-A1 Substituted 3-pyridyl indoles and indazoles as c17,20 lyase inhibitors BAYER PHARMACEUTICALS CORPORATION 2004-11-25 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-20040236110-A1 Substituted 3-pyridyl indoles and indazoles as c17,20 lyase inhibitors CYP17A1, IDO1, CYP21A2 HTR1D 1156/4885CYP11B1 30/4885CYP11B2 53/4885

“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.