SCHEMBL1178043

SCHEMBL1178043

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

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.41
USP2 O75604 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CTSK P43235 1/20 0.36
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
HPGD P15428 1/20 0.34
EPHX2 P34913 1/20 0.34

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
SCHEMBL12870257 1.00 NR1H2 (0.41) NR1H2USP2SMN1; SMN2CTSKHSD17B10
SCHEMBL1178044 1.00 NR1H2 (0.41) NR1H2USP2SMN1; SMN2CTSKHSD17B10
SCHEMBL1178045 1.00 NR1H2 (0.41) NR1H2USP2SMN1; SMN2CTSKHSD17B10
SCHEMBL27308951 0.93 HSD17B10 (0.39) NR1H2SMN1; SMN2CTSKHSD17B10MEN1
SCHEMBL27307619 0.93 HSD17B10 (0.39) NR1H2SMN1; SMN2CTSKHSD17B10MEN1
SCHEMBL29229184 0.93 HSD17B10 (0.39) NR1H2SMN1; SMN2CTSKHSD17B10MEN1
SCHEMBL30181410 0.88 NR1H2 (0.41) NR1H2USP2SMN1; SMN2CTSKHSD17B10
SCHEMBL16914071 0.83 NR1H2 (0.40) NR1H2USP2SMN1; SMN2CTSKHSD17B10
SCHEMBL23545833 0.82 HSD17B10 (0.39) NR1H2SMN1; SMN2CTSKHSD17B10MEN1
SCHEMBL29805015 0.82 HSD17B10 (0.39) NR1H2SMN1; SMN2CTSKHSD17B10MEN1

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-A1 TETRAHYDROCYCLOPENTAÝB¨INDOLE ANDROGEN RECEPTOR MODULATORS Eli Lilly & Company (US) 2011-03-23 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 NR1H2 111/4885USP2 4353/4885SMN1; SMN2 1031/4885

“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.