SCHEMBL6575217

SCHEMBL6575217

COc1ccc(CCN(C)CCOc2ccc(N)cc2)cc1OC

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.67
CYP3A4 P08684 2/20 0.67
CYP2D6 P10635 2/20 0.67
BLM P54132 2/20 0.65
PMP22 Q01453 1/20 0.65
CYP19A1 P11511 1/20 0.58
KCNH2 Q12809 5/20 0.57
AOC3 Q16853 1/20 0.56
KDM4E B2RXH2 3/20 0.51
SMPD1 P17405 3/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CYP2C9 P11712 1/20 0.50
ATM Q13315 1/20 0.50
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
KMT2A Q03164 1/20 0.49
ABCB1 P08183 1/20 0.47

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
Hydrochloric Acid SCHEMBL9054039 0.99 BLM (0.68) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL8789951 0.94 CYP3A4 (0.65) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL8790366 0.88 TSHR (0.53) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL2770457 0.88 CYP1A2 (0.81) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL9053806 0.85 CYP3A4 (0.60) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL8790478 0.85 KCNH2 (0.76) CYP19A1KCNH2AOC3SMPD1
SCHEMBL9054368 0.85 CYP3A4 (0.63) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL7024969 0.85 KCNH2 (0.73) KCNH2AOC3
SCHEMBL6575294 0.84 CYP1A2 (0.62) CYP1A2CYP3A4CYP2D6BLMPMP22
SCHEMBL6571947 0.84 CYP1A2 (0.62) CYP1A2CYP3A4CYP2D6BLMPMP22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0775689-B9 NOVEL AMINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF AS ANTIARRHYTHMIC C & C RES LABS (KR) 2004-09-15 EP disclosed
EP-0775689-B1 NOVEL AMINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF AS ANTIARRHYTHMIC C & C RES LABS (KR) 2003-09-03 EP disclosed
US-6057358-A POTASSIUM CHANNEL BLOCKING ANTIARRHYTHMIC DRUGS WITH LESS SIDE EFFECTS C&C RESEARCH LABS. (KR) 2000-05-02 US disclosed
US-5663179-A CAN SENSITIZE MULTIDRUG RESISTANT CANCER CELLS TO CHEMOTHERAPEUTIC AGENTS LABORATOIRES GLAXO SA (FR) 1997-09-02 US disclosed
EP-0569380-B1 ACRIDINE DERIVATIVES GLAXO LAB SA (FR) 1997-05-28 EP disclosed
EP-0775689-A1 NOVEL AMINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF AS ANTIARRHYTHMIC C & C RESEARCH LABS. (KR) 1997-05-28 EP disclosed
EP-0649410-B1 ANILIDE DERIVATIVES GLAXO LAB SA (FR) 1997-05-02 EP disclosed
US-5604237-A IMPROVE OR INCREASE EFFICACY OF ANTITUMOR AGENT, INCREASE OR RESTORE SENSITIVITY OF TUMOR TO ANTITUMOR AGENT, REVERSE OR REDUCE RESISTANCE OF TUMOR TO ANTITUMOR AGENT LABORATOIRES GLAXO SA (FR) 1997-02-18 US disclosed
WO-1996000715-A1 NEW [2-(3,4-DIMETHOXY-PHENYL)-ETHYL]-(2-PHENOXY-ETHYL)-AMINES, A PROCESS FOR PREPARING THE SAME AND THEIR USE AS MEDICAMENTS ARZNEIMITTELWERK DRESDEN GMGH (DE) 1996-01-11 WO disclosed
EP-0649410-A1 ANILIDE DERIVATIVES. GLAXO LAB SA (FR) 1995-04-26 EP disclosed
WO-1994001408-A1 ANILIDE DERIVATIVES LABORATOIRES GLAXO S.A. (FR) 1994-01-20 WO disclosed
EP-0494623-A1 Acridine derivatives LABORATOIRES GLAXO SA (FR) 1992-07-15 EP disclosed