SCHEMBL2027538

SCHEMBL2027538

CN(C)S(=O)(=O)NC1Cc2c(n(Cc3cccnc3N3C(=O)c4ccccc4C3=O)c3ccc(C#N)cc23)C1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SCARB1 Q8WTV0 1/20 0.36
▸ HTR6 P50406 2/20 0.35
▸ HRH1 P35367 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.32
▸ BRD4 O60885 1/20 0.30
▸ PARG Q86W56 1/20 0.30

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
SCHEMBL2022793 1.00 SCARB1 (0.36) SCARB1HTR6HRH1TDP1BRD4
SCHEMBL14218052 0.89 PTGDR2 (0.31) —
SCHEMBL2024391 0.86 SCARB1 (0.39) SCARB1HTR6HRH1
SCHEMBL2024390 0.86 SCARB1 (0.39) SCARB1HTR6HRH1
SCHEMBL2027983 0.83 HTR6 (0.47) SCARB1HTR6HRH1PARG
SCHEMBL2021412 0.83 HTR6 (0.47) SCARB1HTR6HRH1PARG
SCHEMBL16493810 0.83 HRH1 (0.39) SCARB1HTR6HRH1BRD4
SCHEMBL16493813 0.83 HRH1 (0.39) SCARB1HTR6HRH1BRD4
SCHEMBL12579067 0.83 HTR6 (0.47) SCARB1HTR6HRH1PARG
SCHEMBL16493655 0.83 DRD2 (0.37) HTR6HRH1

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
EP-2094658-B1 TETRAHYDROCYCLOPENTA[B]INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS LILLY CO ELI (US) 2011-12-21 — — EP disclosed
US-7968587-B2 Tetrahydrocyclopenta[b]indole compounds as androgen receptor modulators ELI LILLY AND COMPANY (US) 2011-06-28 — — US disclosed
US-20100069404-A1 TETRAHYDROCYCLOPENTA[b] INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS ELI LILLY AND COMPANY 2010-03-18 — — 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-20100069404-A1 TETRAHYDROCYCLOPENTA[b] INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, NR5A1, MUSK SCARB1 1045/4885HTR6 251/4885HRH1 1313/4885

“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.

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