SCHEMBL1812788

SCHEMBL1812788

COC(=O)c1cc(-c2csc(C)n2)n[nH]1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALPL P05186 11/20 0.56
▸ MAPT P10636 6/20 0.56
▸ RAB9A P51151 3/20 0.56
▸ POLB P06746 2/20 0.56
▸ GAA P10253 1/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ LMNA P02545 1/20 0.51
▸ MAPK1 P28482 1/20 0.50
▸ HTT P42858 1/20 0.45
▸ GFER P55789 1/20 0.44
▸ HPGDS O60760 1/20 0.43

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
SCHEMBL1815173 0.84 ALPL (0.53) ALPLRAB9APOLBGAAHTT
SCHEMBL28799605 0.74 KDM4A (0.42) MAPTRAB9APOLBGAASMN1; SMN2
SCHEMBL4788746 0.72 GAA (0.75) ALPLMAPTRAB9APOLBGAA
SCHEMBL28799606 0.71 KDM4A (0.45) MAPTRAB9APOLBGAASMN1; SMN2
SCHEMBL171413 0.71 MAPK1 (0.67) ALPLMAPTRAB9APOLBGAA
SCHEMBL27261852 0.71 RAB9A (0.47) MAPTRAB9APOLBGAASMN1; SMN2
SCHEMBL646099 0.70 GAA (1.00) ALPLMAPTRAB9APOLBGAA
Bromide SCHEMBL7892522 0.70 RAB9A (0.49) MAPTRAB9APOLBGAASMN1; SMN2
SCHEMBL5350275 0.69 RAB9A (0.68) MAPTRAB9APOLBGAASMN1; SMN2
Hydrochloric Acid SCHEMBL1314014 0.69 GAA (0.97) ALPLMAPTRAB9APOLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3885340-B1 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORP (FI) 2024-11-27 — — EP disclosed
EP-3885340-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORPORATION (FI) 2021-09-29 — — EP disclosed
US-11046713-B2 Androgen receptor modulating compounds ORION CORPORATION (FI) 2021-06-29 — — US disclosed
EP-3369732-B1 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORP (FI) 2021-05-26 — — EP disclosed
US-20200299307-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORP (FI) 2020-09-24 — — US disclosed
US-10711013-B2 Androgen receptor modulating compounds ORION CORPORATION (FI) 2020-07-14 — — US disclosed
US-20190100536-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORP (FI) 2019-04-04 — — US disclosed
US-10118933-B2 Androgen receptor modulating compounds ORION CORPORATION (FI) 2018-11-06 — — US disclosed
EP-3369732-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORPORATION (FI) 2018-09-05 — — EP disclosed
EP-3056485-B1 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORP (FI) 2018-05-09 — — EP disclosed
US-20170260206-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORP (FI) 2017-09-14 — — US disclosed
US-9657003-B2 Androgen receptor modulating compounds ORION CORPORATION (FI) 2017-05-23 — — US disclosed
EP-3056485-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS Orion Corporation (FI) 2016-08-17 — — EP disclosed
US-20150203479-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORPORATION 2015-07-23 — — US disclosed
US-8975254-B2 Androgen receptor modulating compounds ORION CORPORATION (FI) 2015-03-10 — — US disclosed
EP-2493858-B1 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORP (FI) 2014-07-02 — — EP disclosed
US-20120225867-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORPORATION (FI) 2012-09-06 — — US disclosed
EP-2493858-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS Orion Corporation (FI) 2012-09-05 — — EP disclosed
WO-2011051540-A9 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORPORATION (FI) 2012-06-21 — — WO disclosed
WO-2011051540-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS ORION CORPORATION (FI) 2011-05-05 — — 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 (8 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-20170260206-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS AR, NR5A1, SHBG ALPL 3230/4885MAPT 3306/4885RAB9A 2470/4885
US-10118933-B2 Androgen receptor modulating compounds AR, NR5A1, SHBG ALPL 3230/4885MAPT 3306/4885RAB9A 2470/4885
US-10711013-B2 Androgen receptor modulating compounds AR, NR5A1, SHBG ALPL 3230/4885MAPT 3306/4885RAB9A 2470/4885
US-20200299307-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS AR, NR5A1, SHBG ALPL 3230/4885MAPT 3306/4885RAB9A 2470/4885
US-20190100536-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS AR, NR5A1, SHBG ALPL 3230/4885MAPT 3306/4885RAB9A 2470/4885
US-11046713-B2 Androgen receptor modulating compounds AR, NR5A1, SHBG ALPL 3230/4885MAPT 3306/4885RAB9A 2470/4885
US-20150203479-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS AR, NR5A1, SHBG ALPL 3230/4885MAPT 3306/4885RAB9A 2470/4885
US-20120225867-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS AR, NR5A1, SHBG ALPL 3230/4885MAPT 3306/4885RAB9A 2470/4885

“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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