SCHEMBL546576

SCHEMBL546576

C[C@@H]1CC(=O)C[C@H]2CCCCN21

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.50
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
BRCA1 P38398 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GAA P10253 2/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 4/20 0.34
SRD5A2 P31213 1/20 0.34
MCOLN3 Q8TDD5 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL10996925 0.73 HRH3 (0.36) KMT2AMEN1GAAALDH1A1HPGD
SCHEMBL30341037 0.72 HRH3 (0.35) KMT2AMEN1GAAALDH1A1HPGD
SCHEMBL633803 0.72 HRH3 (0.36) KMT2AMEN1GAALMNAPOLB
SCHEMBL6496552 0.72 HRH3 (0.36) KMT2AMEN1GAALMNAPOLB
SCHEMBL16254919 0.72 HRH3 (0.35) KMT2AMEN1GAAALDH1A1HPGD
SCHEMBL18768680 0.72 HRH3 (0.36) KMT2AMEN1GAALMNAPOLB
SCHEMBL10814285 0.72 HRH3 (0.35) GAAHPGD
SCHEMBL7021706 0.72 HRH3 (0.35) KMT2AMEN1GAAALDH1A1HPGD
SCHEMBL21160967 0.72 HRH3 (0.36) KMT2AMEN1GAALMNAPOLB
SCHEMBL18411877 0.72 HRH3 (0.35) GAAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8231913-B2 Angina pectoris and ischemic heart disease and synergistic phytoceutical composition for same OLALDE RANGEL JOSE ANGEL (VE) 2012-07-31 US disclosed
US-8110230-B2 Synergistic phytoceutical compositions OLALDE RANGEL JOSE ANGEL (VE) 2012-02-07 US disclosed
US-8062680-B2 Synergistic phytoceutical compositions OLALDE RANGEL JOSE ANGEL (VE) 2011-11-22 US disclosed
WO-2011056244-A1 ANGINA PECTORIS AND ISCHEMIC HEART DISEASE AND SYNERGISTIC PHYTOCEUTICAL COMPOSITION FOR SAME OLALDE RANGEL JOSE ANGEL (US) 2011-05-12 WO disclosed
US-20110052718-A1 Synergistic Phytoceutical Compositions RANGEL JOSE ANGEL OLALDE 2011-03-03 US disclosed
US-20100143398-A1 Synergistic Phytoceutical Compositions OLALDE RANGEL JOSE ANGEL 2010-06-10 US disclosed
US-20100143397-A1 Synergistic Phytoceutical Compositions OLALDE RANGEL JOSE ANGEL 2010-06-10 US disclosed
US-20100119629-A1 ANGINA PECTORIS AND ISCHEMIC HEART DISEASE AND SYNERGISTIC PHYTOCEUTICAL COMPOSITION FOR SAME OLALDE RANGEL JOSE ANGEL 2010-05-13 US disclosed
US-7682616-B2 Synergistic phytoceutical compositions OLALDE RANGEL JOSE ANGEL 2010-03-23 US disclosed
US-7682617-B2 Synergistic phytoceutical compositions OLALDE RANGEL JOSE ANGEL 2010-03-23 US disclosed
US-7618639-B2 Synergistic phytoceutical compositions OLALDE RANGEL JOSE ANGEL 2009-11-17 US disclosed
US-20090196941-A1 Synergistic Phytoceutical Compositions OLALDE RANGEL JOSE ANGEL 2009-08-06 US disclosed
US-20090155377-A1 Synergistic Phytoceutical Compositions OLALDE RANGEL JOSE ANGEL 2009-06-18 US disclosed
US-7498048-B2 Renal phyto-nutraceutical composition Rangel, Jose Angel Olalde (US) 2009-03-03 US disclosed
US-20080118584-A1 Renal Synergistic Phyto-Nutraceutical Composition OLALDE RANGEL JOSE ANGEL 2008-05-22 US disclosed
US-20080089946-A1 Synergistic Phytoceutical Compositions OLALDE RANGEL JOSE A 2008-04-17 US disclosed
US-7303772-B2 Synergistic phytoceutical compositions OLALDE RANGEL JOSE ANGEL 2007-12-04 US disclosed
WO-2007059441-A2 SYNERGISTIC PHYTOCEUTICAL COMPOSITIONS OLALDE RANGEL JOSE ANGEL (US) 2007-05-24 WO disclosed
US-20070104728-A1 Synergistic phytoceutical compositions OLALDE RANGEL JOSE A 2007-05-10 US disclosed