SCHEMBL7529519

SCHEMBL7529519

C[C@]12CCC(=O)NC1=CC[C@@H]1[C@H]2CC[C@]2(C)C(=O)CC[C@@H]12

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 14/20 0.58
SRD5A1 P18405 2/20 0.55
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
SHBG P04278 1/20 0.55
SERPINA6 P08185 1/20 0.55
GUSB P08236 1/20 0.55
CYP3A4 P08684 1/20 0.55
G6PD P11413 1/20 0.55
PMP22 Q01453 1/20 0.55
KMT2A Q03164 1/20 0.55
GPBAR1 Q8TDU6 1/20 0.55
TSHR P16473 1/20 0.55

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
SCHEMBL3797856 1.00 CYP19A1 (0.58) CYP19A1SRD5A1MEN1LMNASHBG
SCHEMBL10274355 0.92 CYP19A1 (0.66) CYP19A1MEN1LMNASHBGSERPINA6
SCHEMBL7523372 0.84 CYP17A1 (0.57) CYP19A1SRD5A1MEN1LMNASHBG
SCHEMBL7523360 0.84 CYP17A1 (0.57) CYP19A1SRD5A1MEN1LMNASHBG
SCHEMBL7523365 0.84 CYP17A1 (0.57) CYP19A1SRD5A1MEN1LMNASHBG
SCHEMBL3803940 0.84 CYP17A1 (0.57) CYP19A1SRD5A1MEN1LMNASHBG
SCHEMBL3803939 0.84 CYP17A1 (0.57) CYP19A1SRD5A1MEN1LMNASHBG
SCHEMBL5183889 0.84 SRD5A1 (0.53) CYP19A1SRD5A1
SCHEMBL5183886 0.84 SRD5A1 (0.53) CYP19A1SRD5A1
SCHEMBL5423822 0.83 SRD5A1 (0.51) CYP19A1SRD5A1MEN1LMNASHBG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0880540-B1 17-BETA-CYCLOPROPYL(AMINO/OXY) 4-AZA STEROIDS AS ACTIVE INHIBITORS OF TESTOSTERONE 5-ALPHA-REDUCTASE AND C17-20-LYASE AVENTIS PHARMA INC (US) 2002-06-12 EP disclosed
US-6365597-B1 FOR THERAPY OF ANDROGEN AND ESTROGEN MEDIATED DISORDERS, INCLUDING BENIGN PROSTATIC HYPERPLASIA, ANDROGEN MEDIATED PROSTATE CANCER, ESTROGEN MEDIATED BREAST CANCER AND ACNE AVENTIS PHARMACEUTICALS INC. 2002-04-02 US disclosed
EP-0705273-B1 17-HALOGENO-4-AZAANDROSTENE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF RICHTER GEDEON VEGYESZET (HU) 2002-03-27 EP disclosed
EP-0705272-B1 NOVEL PROCESS FOR PREPARING 17 BETA-SUBSTITUTED 4-AZAANDROSTANE DERIVATIVES RICHTER GEDEON VEGYESZET (HU) 2002-03-27 EP disclosed
EP-0880540-A1 17-BETA-CYCLOPROPYL(AMINO/OXY) 4-AZA STEROIDS AS ACTIVE INHIBITORS OF TESTOSTERONE 5-ALPHA-REDUCTASE AND C17-20-LYASE HOECHST MARION ROUSSEL, INC. (US) 1998-12-02 EP disclosed
WO-1997030069-A1 17-BETA-CYCLOPROPYL(AMINO/OXY) 4-AZA STEROIDS AS ACTIVE INHIBITORS OF TESTOSTERONE 5-ALPHA-REDUCTASE AND C17-20-LYASE HOECHST MARION ROUSSEL, INC. (US) 1997-08-21 WO disclosed
US-5583228-A 17-halogeno-4-azaandrostene derivatives and process for the preparation thereof RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1996-12-10 US disclosed
US-5583138-A REDUCTASE INHIBITOR; SKIN DISORDERS RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1996-12-10 US disclosed
EP-0705273-A1 17-HALOGENO-4-AZAANDROSTENE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1996-04-10 EP disclosed
EP-0705272-A1 NOVEL PROCESS FOR PREPARING 17 BETA-SUBSTITUTED 4-AZAANDROSTANE DERIVATIVES RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1996-04-10 EP disclosed
EP-0662977-A1 NOVEL 17$g(b)-SUBSTITUTED 4-AZAANDROSTANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1995-07-19 EP disclosed
WO-1995000532-A1 17-HALOGENO-4-AZAANDROSTENE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Richter Gedeon Vegyészeti Gyár Rt. (HU) 1995-01-05 WO disclosed
WO-1995000531-A1 NOVEL PROCESS FOR PREPARING 17β-SUBSTITUTED 4-AZAANDROSTANE DERIVATIVES Richter Gedeon Vegyészeti Gyár Rt. (HU) 1995-01-05 WO disclosed
WO-1994007909-A1 NOVEL 17β-SUBSTITUTED 4-AZAANDROSTANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME Richter Gedeon Vegyészeti Gyár Rt. (HU) 1994-04-14 WO disclosed