SCHEMBL1817328

SCHEMBL1817328

N#Cc1ccc(-c2ccnn2C2CCCCO2)cc1C#N

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ATR Q13535 12/20 0.50
CYP4F2 P78329 5/20 0.48
CYP4A11 Q02928 5/20 0.48
IDH1 O75874 1/20 0.40
EGLN2 Q96KS0 1/20 0.38

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
SCHEMBL12079955 0.89 ATR (0.48) ATRCYP4F2CYP4A11IDH1EGLN2
SCHEMBL1816296 0.86 AR (0.49) ATRCYP4F2CYP4A11EGLN2
SCHEMBL1814103 0.85 ATR (0.45) ATRCYP4F2CYP4A11IDH1
SCHEMBL1816728 0.85 ATR (0.45) ATRCYP4F2CYP4A11IDH1
SCHEMBL25378387 0.81 CYP4F2 (0.47) ATRCYP4F2CYP4A11EGLN2
SCHEMBL1814288 0.81 CYP4F2 (0.55) ATRCYP4F2CYP4A11IDH1EGLN2
SCHEMBL25377392 0.80 ATR (0.48) ATRCYP4F2CYP4A11IDH1
SCHEMBL18985877 0.80 CYP4F2 (0.50) ATRCYP4F2CYP4A11IDH1
SCHEMBL12079810 0.80 CYP4F2 (0.50) ATRCYP4F2CYP4A11IDH1
SCHEMBL30763853 0.79 ATR (0.48) ATRCYP4F2CYP4A11

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 19 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
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 ATR 2931/4885CYP4F2 245/4885CYP4A11 98/4885
US-10118933-B2 Androgen receptor modulating compounds AR, NR5A1, SHBG ATR 2931/4885CYP4F2 245/4885CYP4A11 98/4885
US-10711013-B2 Androgen receptor modulating compounds AR, NR5A1, SHBG ATR 2931/4885CYP4F2 245/4885CYP4A11 98/4885
US-20200299307-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS AR, NR5A1, SHBG ATR 2931/4885CYP4F2 245/4885CYP4A11 98/4885
US-20190100536-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS AR, NR5A1, SHBG ATR 2931/4885CYP4F2 245/4885CYP4A11 98/4885
US-11046713-B2 Androgen receptor modulating compounds AR, NR5A1, SHBG ATR 2931/4885CYP4F2 245/4885CYP4A11 98/4885
US-20150203479-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS AR, NR5A1, SHBG ATR 2931/4885CYP4F2 245/4885CYP4A11 98/4885
US-20120225867-A1 ANDROGEN RECEPTOR MODULATING COMPOUNDS AR, NR5A1, SHBG ATR 2931/4885CYP4F2 245/4885CYP4A11 98/4885

“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.