SCHEMBL12579079

SCHEMBL12579079

CN(C)S(=O)(=O)NC1Cc2c(n(Cc3cnccn3)c3ccc(C#N)cc23)C1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SCARB1 Q8WTV0 3/20 0.41
▸ HRH1 P35367 2/20 0.38
▸ HTR6 P50406 2/20 0.38
▸ PARG Q86W56 2/20 0.37
▸ FNTA P49354 4/20 0.33
▸ FNTB P49356 4/20 0.33
▸ VNN1 O95497 1/20 0.32
▸ ICAM1 P05362 1/20 0.31
▸ VCAM1 P19320 1/20 0.31
▸ JAK2 O60674 1/20 0.31
▸ JAK1 P23458 1/20 0.31
▸ TYK2 P29597 1/20 0.31
▸ CYP11B1 P15538 1/20 0.31
▸ CYP11B2 P19099 1/20 0.31

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
SCHEMBL2021687 1.00 SCARB1 (0.41) SCARB1HRH1HTR6PARGFNTA
SCHEMBL2021685 1.00 SCARB1 (0.41) SCARB1HRH1HTR6PARGFNTA
SCHEMBL12579067 0.90 HTR6 (0.47) SCARB1HRH1HTR6PARGFNTA
SCHEMBL2027983 0.90 HTR6 (0.47) SCARB1HRH1HTR6PARGFNTA
SCHEMBL2021412 0.90 HTR6 (0.47) SCARB1HRH1HTR6PARGFNTA
SCHEMBL2027250 0.86 SCARB1 (0.40) SCARB1HRH1HTR6FNTAFNTB
SCHEMBL2027251 0.86 SCARB1 (0.40) SCARB1HRH1HTR6FNTAFNTB
SCHEMBL2024210 0.86 SCARB1 (0.40) SCARB1HRH1HTR6PARG
SCHEMBL2024211 0.86 SCARB1 (0.40) SCARB1HRH1HTR6PARG
SCHEMBL2025821 0.85 SCARB1 (0.41) SCARB1HRH1HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 1045/4885HRH1 1313/4885HTR6 251/4885

“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.

Send feedback