SCHEMBL1179063

SCHEMBL1179063

CC(C)(C)OC(=O)N1CC[C@H](O)[C@H]1COS(C)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 1/20 0.39
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
GPR119 Q8TDV5 6/20 0.35
HSD17B10 Q99714 1/20 0.34
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL1420674 1.00 HCRTR2 (0.39) HCRTR2CHRM2CHRM1CHRM3GPR119
SCHEMBL13415923 0.88 HCRTR2 (0.40) HCRTR2CHRM2CHRM1CHRM3GPR119
SCHEMBL651147 0.84 HCRTR2 (0.38) HCRTR2CHRM2CHRM1CHRM3GPR119
SCHEMBL28960535 0.84 HCRTR2 (0.38) HCRTR2CHRM2CHRM1CHRM3GPR119
SCHEMBL489371 0.83 NR1H2 (0.39) HCRTR2CHRM2CHRM1CHRM3GPR119
SCHEMBL489369 0.83 NR1H2 (0.39) HCRTR2CHRM2CHRM1CHRM3GPR119
SCHEMBL1799021 0.83 NR1H2 (0.39) HCRTR2CHRM2CHRM1CHRM3GPR119
SCHEMBL653778 0.81 NR1H2 (0.43) CHRM2CHRM1CHRM3HSD17B10HPGD
SCHEMBL1178180 0.81 NR1H2 (0.43) CHRM2CHRM1CHRM3HSD17B10HPGD
SCHEMBL8199039 0.81 NR1H2 (0.43) CHRM2CHRM1CHRM3HSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8486943-B2 Tetrahydrocyclopenta[b]indole androgen receptor modulators ELI LILLY AND COMPANY (US) 2013-07-16 US disclosed
US-8486943-B2 Tetrahydrocyclopenta[b]indole androgen receptor modulators ELI LILLY AND COMPANY (US) 2013-07-16 US disclosed
US-8486943-B2 Tetrahydrocyclopenta[b]indole androgen receptor modulators ELI LILLY AND COMPANY (US) 2013-07-16 US disclosed
EP-2297100-B1 TETRAHYDROCYCLOPENTA[B]INDOLE ANDROGEN RECEPTOR MODULATORS LILLY CO ELI (US) 2012-10-31 EP disclosed
EP-2297100-B1 TETRAHYDROCYCLOPENTA[B]INDOLE ANDROGEN RECEPTOR MODULATORS LILLY CO ELI (US) 2012-10-31 EP disclosed
US-20110039855-A1 Tetrahydrocyclopenta[b]indole Androgen Receptor Modulators ELI LILLY AND COMPANY (US) 2011-02-17 US disclosed
US-20110039855-A1 Tetrahydrocyclopenta[b]indole Androgen Receptor Modulators ELI LILLY AND COMPANY (US) 2011-02-17 US disclosed
US-20110039855-A1 Tetrahydrocyclopenta[b]indole Androgen Receptor Modulators ELI LILLY AND COMPANY (US) 2011-02-17 US disclosed
WO-2009140448-A1 TETRAHYDROCYCLOPENTA[B]INDOLE ANDROGEN RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2009-11-19 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-20110039855-A1 Tetrahydrocyclopenta[b]indole Androgen Receptor Modulators AR, ADRA1B, ADRB1 HCRTR2 1054/4885CHRM2 124/4885CHRM1 186/4885

“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.