SCHEMBL917870

SCHEMBL917870

CN1C(=O)C=C[C@]2(C)[C@H]3CC[C@]4(C)[C@@H](C(=O)Nc5ccncc5)CC[C@H]4[C@@H]3CC[C@@H]12

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.67
SRD5A2 P31213 3/20 0.58
KCNH2 Q12809 2/20 0.58
SRD5A1 P18405 4/20 0.56

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
SCHEMBL917872 1.00 AR (0.67) ARSRD5A2KCNH2SRD5A1
SCHEMBL5253828 0.91 AR (0.74) ARSRD5A2SRD5A1
SCHEMBL5217888 0.91 AR (0.74) ARSRD5A2SRD5A1
SCHEMBL5212988 0.90 AR (0.68) ARSRD5A2SRD5A1
SCHEMBL5214723 0.90 AR (0.68) ARSRD5A2SRD5A1
SCHEMBL917859 0.90 AR (0.66) ARSRD5A2KCNH2SRD5A1
SCHEMBL917861 0.90 AR (0.66) ARSRD5A2KCNH2SRD5A1
SCHEMBL5214666 0.89 AR (0.70) ARSRD5A2SRD5A1
SCHEMBL5214678 0.89 AR (0.70) ARSRD5A2SRD5A1
SCHEMBL916476 0.89 SRD5A1 (0.68) ARSRD5A2SRD5A1

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2371367-A1 Method of treating men with testosterone supplement and 5alpha reductase inhibitor MERCK SHARP & DOHME (I.A.) CORP. (US) 2011-10-05 EP claimed
US-20110136769-A1 METHOD OF TREATING MEN WITH TESTOSTERONE SUPPLEMENT AND 5ALPHA-REDUCTASE INHIBITOR MERCK SHARP & DOHME CORP. (US) 2011-06-09 US claimed
US-20110092470-A1 METHOD OF TREATING MEN WITH ERECTILE DYSFUNCTION MEEHAN ALAN 2011-04-21 US claimed
EP-2305352-A1 5-alpha-reductase inhibitors for use in the treatment of men with metabolic and anthropometric disorders Merck Sharp & Dohme Corp. (US) 2011-04-06 EP claimed
US-20110015164-A1 METHOD OF TREATING MEN WITH METABOLIC AND ANTHROPOMETRIC DISORDERS MEEHAN ALAN 2011-01-20 US claimed
US-20090123571-A1 Method of treating men with testosterone supplement and 5alpha-reductase inhibitor MERCK SHARP & DOHME CORP. 2009-05-14 US claimed
US-20080125403-A1 Method of Treating Men with Metabolic and Anthropometric Disorders MERCK & CO., INC. (US) 2008-05-29 US claimed
US-RE39056-E1 4-Azasteroids for treatment of hyperandrogenic conditions MERCK & CO, INC. (US) 2006-04-04 US claimed
EP-0859761-A4 4-AZASTEROIDS FOR TREATMENT OF HYPERANDROGENIC CONDITIONS MERCK & CO INC (US) 2000-01-26 EP claimed
US-6001844-A 4-Azasteroids for treatment of hyperandrogenic conditions MERCK & CO., INC. (US) 1999-12-14 US claimed
EP-0859761-A1 4-AZASTEROIDS FOR TREATMENT OF HYPERANDROGENIC CONDITIONS Merck & Co., Inc. (US) 1998-08-26 EP claimed
WO-1997010217-A1 4-AZASTEROIDS FOR TREATMENT OF HYPERANDROGENIC CONDITIONS MERCK & CO., INC. (US) 1997-03-20 WO claimed
EP-2371367-A1 Method of treating men with testosterone supplement and 5alpha reductase inhibitor MERCK SHARP & DOHME (I.A.) CORP. (US) 2011-10-05 EP disclosed
US-20110136769-A1 METHOD OF TREATING MEN WITH TESTOSTERONE SUPPLEMENT AND 5ALPHA-REDUCTASE INHIBITOR MERCK SHARP & DOHME CORP. (US) 2011-06-09 US disclosed
US-20110092470-A1 METHOD OF TREATING MEN WITH ERECTILE DYSFUNCTION MEEHAN ALAN 2011-04-21 US disclosed
EP-2305352-A1 5-alpha-reductase inhibitors for use in the treatment of men with metabolic and anthropometric disorders Merck Sharp & Dohme Corp. (US) 2011-04-06 EP disclosed
EP-0859761-A4 4-AZASTEROIDS FOR TREATMENT OF HYPERANDROGENIC CONDITIONS MERCK & CO INC (US) 2000-01-26 EP disclosed
US-6001844-A 4-Azasteroids for treatment of hyperandrogenic conditions MERCK & CO., INC. (US) 1999-12-14 US disclosed
EP-0859761-A1 4-AZASTEROIDS FOR TREATMENT OF HYPERANDROGENIC CONDITIONS Merck & Co., Inc. (US) 1998-08-26 EP disclosed
WO-1997010217-A1 4-AZASTEROIDS FOR TREATMENT OF HYPERANDROGENIC CONDITIONS MERCK & CO., INC. (US) 1997-03-20 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 (5 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-20090123571-A1 Method of treating men with testosterone supplement and 5alpha-reductase inhibitor ADRA1D, ADRB1, AGER AR 22/4885SRD5A2 26/4885KCNH2 3737/4885
US-20110136769-A1 METHOD OF TREATING MEN WITH TESTOSTERONE SUPPLEMENT AND 5ALPHA-REDUCTASE INHIBITOR ADRA1D, ADRB1, AGER AR 22/4885SRD5A2 26/4885KCNH2 3737/4885
US-20110015164-A1 METHOD OF TREATING MEN WITH METABOLIC AND ANTHROPOMETRIC DISORDERS CYP17A1, SHBG, CYP21A2 AR 12/4885SRD5A2 4/4885KCNH2 2156/4885
US-20110092470-A1 METHOD OF TREATING MEN WITH ERECTILE DYSFUNCTION ADRA1D, ADRB1, AGER AR 34/4885SRD5A2 53/4885KCNH2 2810/4885
US-20080125403-A1 Method of Treating Men with Metabolic and Anthropometric Disorders CYP17A1, SHBG, CYP21A2 AR 12/4885SRD5A2 4/4885KCNH2 2156/4885

“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.