SCHEMBL4837671

SCHEMBL4837671

Cc1cccc(NC(=O)N[C@H]2CCC3C4CC[C@H]5N(C)C(=O)C=C[C@]5(C)C4CC[C@@]32C)c1C

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AR P10275 8/20 0.56
KCNH2 Q12809 5/20 0.51
SRD5A2 P31213 1/20 0.49

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
SCHEMBL4837663 1.00 AR (0.56) ARKCNH2SRD5A2
SCHEMBL2641718 1.00 AR (0.56) ARKCNH2SRD5A2
SCHEMBL14223684 0.93 AR (0.60) ARKCNH2SRD5A2
SCHEMBL2640079 0.88 AR (0.56) ARKCNH2SRD5A2
SCHEMBL4800871 0.88 AR (0.56) ARKCNH2SRD5A2
SCHEMBL4800880 0.88 AR (0.56) ARKCNH2SRD5A2
SCHEMBL14184883 0.88 AR (0.59) ARKCNH2SRD5A2
SCHEMBL8902588 0.87 AR (0.59) ARKCNH2SRD5A2
SCHEMBL8902593 0.87 AR (0.59) ARKCNH2SRD5A2
SCHEMBL4797509 0.85 AR (0.61) ARKCNH2SRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060241107-A1 Androgen receptor modulators and methods of use thereof MERCK SHARP & DOHME LLC 2006-10-26 US 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
US-7351698-B2 Androgen receptor modulators and methods of use thereof MERCK & CO., INC. (US) 2008-04-01 US disclosed
US-20060241107-A1 Androgen receptor modulators and methods of use thereof MERCK SHARP & DOHME LLC 2006-10-26 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.