SCHEMBL2641230

SCHEMBL2641230

CC(=O)c1cccc(NC(=O)N[C@H]2CCC3C4CC[C@H]5N(C)C(=O)C=C[C@]5(C)C4CC[C@@]32C)c1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AR P10275 7/20 0.55
KCNH2 Q12809 5/20 0.50
SRD5A2 P31213 1/20 0.48
SRD5A1 P18405 1/20 0.46

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
SCHEMBL14184877 1.00 AR (0.55) ARKCNH2SRD5A2SRD5A1
SCHEMBL14184875 0.90 AR (0.55) ARKCNH2SRD5A2SRD5A1
SCHEMBL4797391 0.90 AR (0.55) ARKCNH2SRD5A2SRD5A1
SCHEMBL2638964 0.90 AR (0.55) ARKCNH2SRD5A2SRD5A1
SCHEMBL14184873 0.90 AR (0.61) ARKCNH2SRD5A2SRD5A1
SCHEMBL4799106 0.90 AR (0.61) ARKCNH2SRD5A2SRD5A1
SCHEMBL2639164 0.90 AR (0.61) ARKCNH2SRD5A2SRD5A1
SCHEMBL4797509 0.90 AR (0.61) ARKCNH2SRD5A2SRD5A1
SCHEMBL14184874 0.88 AR (0.57) ARKCNH2SRD5A2SRD5A1
SCHEMBL2641300 0.88 AR (0.57) ARKCNH2SRD5A2SRD5A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1622567-B1 ANDROGEN RECEPTOR MODULATORS AND METHODS OF USE THEREOF MERCK SHARP & DOHME (US) 2013-07-24 EP claimed
JP-4832303-B2 2011-12-07 JP claimed
EP-1622567-A4 ANDROGEN RECEPTOR MODULATORS AND METHODS OF USE THEREOF MERCK & CO INC (US) 2009-04-29 EP claimed
US-20060241107-A1 Androgen receptor modulators and methods of use thereof MERCK SHARP & DOHME LLC 2006-10-26 US claimed
EP-1622567-A2 ANDROGEN RECEPTOR MODULATORS AND METHODS OF USE THEREOF Merck & Co., Inc. (US) 2006-02-08 EP claimed
WO-2004100874-A2 ANDROGEN RECEPTOR MODULATORS AND METHODS OF USE THEREOF MERCK & CO., INC. (US) 2004-11-25 WO claimed
EP-1622567-B1 ANDROGEN RECEPTOR MODULATORS AND METHODS OF USE THEREOF MERCK SHARP & DOHME (US) 2013-07-24 EP disclosed
US-20080119503-A1 Androgen receptor modulators and methods of use thereof MERCK SHARP & DOHME CORP. 2008-05-22 US 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-20060241107-A1 Androgen receptor modulators and methods of use thereof SHBG, FSHR, AR AR 3/4885KCNH2 4688/4885SRD5A2 57/4885
US-20080119503-A1 Androgen receptor modulators and methods of use thereof SHBG, FSHR, AR AR 3/4885KCNH2 4688/4885SRD5A2 57/4885

“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.