SCHEMBL2195019

SCHEMBL2195019

CC[C@]12CCCCC1CC[C@@H]1[C@H]2CC[C@]2(C)CCC[C@@H]12

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 1/20 0.48
CDK5R1 Q15078 1/20 0.48
NR1I3 Q14994 1/20 0.48
MBOAT4 Q96T53 3/20 0.42
GRIN1 Q05586 8/20 0.41
GRIN2B Q13224 8/20 0.41
CYP19A1 P11511 4/20 0.36
AKR1B10 O60218 1/20 0.34

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
SCHEMBL947528 0.87 CDK5 (0.47) CDK5CDK5R1NR1I3MBOAT4GRIN1
SCHEMBL26060781 0.87 NR1I3 (0.50) CDK5CDK5R1NR1I3MBOAT4GRIN1
SCHEMBL10878132 0.87 NR1I3 (0.50) CDK5CDK5R1NR1I3MBOAT4GRIN1
SCHEMBL10878141 0.87 NR1I3 (0.50) CDK5CDK5R1NR1I3MBOAT4GRIN1
SCHEMBL11580475 0.87 NR1I3 (0.50) CDK5CDK5R1NR1I3MBOAT4GRIN1
SCHEMBL10886068 0.85 CDK5 (0.48) CDK5CDK5R1NR1I3MBOAT4GRIN1
SCHEMBL10886062 0.85 CDK5 (0.48) CDK5CDK5R1NR1I3MBOAT4GRIN1
SCHEMBL28302658 0.85 CDK5 (0.45) CDK5CDK5R1NR1I3MBOAT4GRIN1
SCHEMBL31620148 0.85 NR1I3 (0.48) CDK5CDK5R1NR1I3MBOAT4GRIN1
SCHEMBL27317899 0.81 GRIN1 (0.55) CDK5CDK5R1NR1I3MBOAT4GRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7972782-B2 Steroid-activated nuclear receptors and uses therefor THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2011-07-05 US disclosed
EP-2036925-A1 Novel steroid-activated nuclear receptors and uses therefor THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2009-03-18 EP disclosed
EP-1235861-B1 TRANSGENIC MOUSE EXPRESSING STEROID-ACTIVATED NUCLEAR RECEPTOR SALK INST FOR BIOLOGICAL STUDI (US) 2008-10-22 EP disclosed
US-7413853-B2 Modulation of metabolism of steroids and xenobiotics THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2008-08-19 US disclosed
EP-1051479-B1 NOVEL STEROID-ACTIVATED NUCLEAR RECEPTORS AND USES THEREFOR SALK INST FOR BIOLOGICAL STUDI (US) 2008-07-16 EP disclosed
US-7214482-B2 Steroid-activated nuclear receptors and uses therefor THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2007-05-08 US disclosed
US-20070026445-A1 Novel steroid-activated nuclear receptors and uses therefor THE SALK INSTITUTE FOR BIOLOGICAL STUDIES 2007-02-01 US disclosed
US-6984773-B1 Transgenic mice expressing a human SXR receptor polypeptide THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2006-01-10 US disclosed
US-6911537-B2 Xenobiotic compound modulated expression systems and uses therefor THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2005-06-28 US disclosed
US-20040254135-A1 Modulation of metabolism of steroids and xenobiotics THE SALK INSTITUTE FOR BIOLOGICAL STUDIES 2004-12-16 US disclosed
US-6809178-B2 POLYPEPTIDE FOR USE IN THE TREATMENT OF ADDISON'S DISEASE THE SALK INSTITUTE FOR BIOLOGICAL STUDIES 2004-10-26 US disclosed
US-20030223993-A1 Novel steroid-activated nuclear receptors and uses therefor THE SALK INTITUTE FOR BIOLOGICAL STUDIES 2003-12-04 US disclosed
US-20030104519-A1 Xenobiotic compound modulated expression systems and uses therefor SALK INSTITUTE FOR BIOLOGICAL STUDIES, THE 2003-06-05 US disclosed
US-20030044888-A1 NOVEL STEROID-ACTIVATED NUCLEAR RECEPTORS AND USES THEREFOR HOWARD HUGHES MEDICAL INSTITUTE 2003-03-06 US disclosed
WO-2003005812-A2 MODULATION OF METABOLISM OF STEROIDS AND XENOBIOTICS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2003-01-23 WO disclosed
EP-1051479-A4 NOVEL STEROID-ACTIVATED NUCLEAR RECEPTORS AND USES THEREFOR SALK INST FOR BIOLOGICAL STUDI (US) 2002-12-04 EP disclosed
WO-2002086063-A2 XENOBIOTIC COMPOUND MODULATED EXPRESSION SYSTEMS AND USES THEREFOR THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2002-10-31 WO disclosed
EP-1051479-A1 NOVEL STEROID-ACTIVATED NUCLEAR RECEPTORS AND USES THEREFOR THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2000-11-15 EP disclosed
WO-1999035246-A9 NOVEL STEROID-ACTIVATED NUCLEAR RECEPTORS AND USES THEREFOR SALK INST FOR BIOLOGICAL STUDI (US) 1999-09-30 WO disclosed
WO-1999035246-A1 NOVEL STEROID-ACTIVATED NUCLEAR RECEPTORS AND USES THEREFOR THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1999-07-15 WO disclosed