SCHEMBL2027524

SCHEMBL2027524

CC(C)OC(=O)N[C@H]1Cc2c(n(Cc3cccnc3NCC(=O)O)c3ccc(C#N)cc23)C1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HRH1 P35367 1/20 0.33
▸ HTR6 P50406 1/20 0.33
▸ GPR6 P46095 4/20 0.32
▸ RET P07949 1/20 0.32
▸ PTGDR2 Q9Y5Y4 5/20 0.32
▸ EGLN2 Q96KS0 1/20 0.31
▸ EGLN1 Q9GZT9 1/20 0.31
▸ EGLN3 Q9H6Z9 1/20 0.31
▸ PPARD Q03181 1/20 0.31
▸ RORC P51449 1/20 0.31
▸ AAK1 Q2M2I8 1/20 0.31
▸ SCARB1 Q8WTV0 2/20 0.30
▸ P2RX7 Q99572 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
SCHEMBL2027527 1.00 HRH1 (0.33) HRH1HTR6GPR6RETPTGDR2
SCHEMBL12640838 0.91 HRH1 (0.33) HRH1HTR6GPR6RETRORC
SCHEMBL14218047 0.89 PTGDR2 (0.32) PTGDR2
SCHEMBL2023482 0.88 HRH1 (0.35) HRH1HTR6GPR6RETPTGDR2
SCHEMBL2023485 0.88 HRH1 (0.35) HRH1HTR6GPR6RETPTGDR2
SCHEMBL16493847 0.86 HRH1 (0.38) HRH1HTR6RETPTGDR2RORC
SCHEMBL1177777 0.84 HRH1 (0.35) HRH1HTR6GPR6RETPTGDR2
SCHEMBL1177774 0.84 HRH1 (0.35) HRH1HTR6GPR6RETPTGDR2
Ly2452473 SCHEMBL2023683 0.83 HRH1 (0.45) HRH1HTR6RETRORCSCARB1
Ly2452473 SCHEMBL2023681 0.83 HRH1 (0.45) HRH1HTR6RETRORCSCARB1

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 8 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
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-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
US-20100069404-A1 TETRAHYDROCYCLOPENTA[b] INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS ELI LILLY AND COMPANY 2010-03-18 — — US disclosed
EP-2094658-A2 TETRAHYDROCYCLOPENTA[B]INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2009-09-02 — — EP disclosed
WO-2008063867-A2 TETRAHYDROCYCLOPENTA[B] INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2008-05-29 — — 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-20100069404-A1 TETRAHYDROCYCLOPENTA[b] INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, NR5A1, MUSK HRH1 1313/4885HTR6 251/4885GPR6 65/4885

“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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