SCHEMBL13844936

SCHEMBL13844936

CC(C)(C)OC(=O)N1CCc2nc(OS(=O)(=O)C(F)(F)F)ccc2C1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
ESR2 Q92731 1/20 0.48
NR1H2 P55055 1/20 0.47
MAPK1 P28482 1/20 0.40
HPGDS O60760 2/20 0.40
GRAMD1A Q96CP6 1/20 0.38
SCN9A Q15858 1/20 0.38
GABRG2 P18507 5/20 0.38
GABRB3 P28472 5/20 0.38
GABRA5 P31644 5/20 0.38
KCNH2 Q12809 3/20 0.38
CYP2B6 P20813 1/20 0.38
CYP2C19 P33261 1/20 0.38
PARP1 P09874 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
PARP2 Q9UGN5 1/20 0.38
ABHD6 Q9BV23 1/20 0.37
ACACB O00763 1/20 0.37
LIPG Q9Y5X9 1/20 0.36

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
SCHEMBL4202187 0.93 ESR2 (0.44) MAPTESR2NR1H2
SCHEMBL30207741 0.93 ESR2 (0.44) MAPTESR2NR1H2
SCHEMBL30474177 0.92 ESR2 (0.48) MAPTESR2NR1H2MAPK1HPGDS
SCHEMBL31413140 0.92 ESR2 (0.48) MAPTESR2NR1H2MAPK1HPGDS
SCHEMBL14147974 0.86 ESR2 (0.44) MAPTESR2NR1H2HPGDS
SCHEMBL13845054 0.83 MAPT (0.57) MAPTESR2NR1H2MAPK1HPGDS
SCHEMBL31505444 0.81 ESR2 (0.53) MAPTESR2NR1H2MAPK1HPGDS
SCHEMBL4203783 0.81 GRM5 (0.37) ESR2GABRG2GABRB3GABRA5KCNH2
SCHEMBL29098274 0.80 ESR2 (0.52) MAPTESR2NR1H2MAPK1HPGDS
SCHEMBL1650187 0.80 NR1H2 (0.63) MAPTESR2NR1H2MAPK1ABHD6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230348439-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES INC (US) 2023-11-02 US disclosed
US-11667624-B2 Indole compounds as androgen receptor modulators NIDO BIOSCIENCES, INC. (US) 2023-06-06 US disclosed
EP-4182320-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS Nido Biosciences, Inc. (US) 2023-05-24 EP disclosed
CN-115996926-A Indole compounds as androgen receptor modulators 尼多生物科学有限公司 2023-04-21 CN disclosed
WO-2022020342-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES, INC. (US) 2022-01-27 WO disclosed
WO-2009056556-A1 SUBSTITUTE 1, 6-NAPHTHYRIDINES FOR USE AS SCD INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-05-07 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 (2 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-20230348439-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, NR5A1 MAPT 682/4885ESR2 51/4885NR1H2 88/4885
US-11667624-B2 Indole compounds as androgen receptor modulators AR, FSHR, ADRB3 MAPT 682/4885ESR2 89/4885NR1H2 134/4885

“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.