SCHEMBL8437892

SCHEMBL8437892

CN(C)Cc1cc2c(o1)CN(C(=O)c1ccc(C=Cc3cccc(Cl)c3)cc1)CC2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.42
LSS P48449 1/20 0.38
PDE4B Q07343 3/20 0.37
KCNH2 Q12809 2/20 0.37
QRFPR Q96P65 2/20 0.37
CYP2D6 P10635 1/20 0.37
KCNE1 P15382 1/20 0.37
SCN5A Q14524 1/20 0.37
MTHFD1 P11586 1/20 0.37
MTHFD2 P13995 1/20 0.37
GPR183 P32249 2/20 0.36
HSD11B1 P28845 1/20 0.35
HPGD P15428 2/20 0.35
TP53 P04637 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.35
PDE4D Q08499 1/20 0.35
ESR1 P03372 1/20 0.35

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
SCHEMBL8437886 1.00 SNCA (0.42) SNCALSSPDE4BKCNH2QRFPR
Hydrochloric Acid SCHEMBL8437160 0.99 SNCA (0.42) SNCALSSPDE4BKCNH2QRFPR
Hydrochloric Acid SCHEMBL8437164 0.99 SNCA (0.42) SNCALSSPDE4BKCNH2QRFPR
SCHEMBL8440702 0.93 SNCA (0.42) SNCALSSPDE4BKCNH2QRFPR
SCHEMBL8440708 0.93 SNCA (0.42) SNCALSSPDE4BKCNH2QRFPR
SCHEMBL8437891 0.93 LSS (0.44) SNCALSSPDE4BKCNH2QRFPR
SCHEMBL8437896 0.93 LSS (0.44) SNCALSSPDE4BKCNH2QRFPR
Hydrochloric Acid SCHEMBL8435604 0.92 SNCA (0.42) SNCALSSPDE4BKCNH2QRFPR
Hydrochloric Acid SCHEMBL8435601 0.92 SNCA (0.42) SNCALSSPDE4BKCNH2QRFPR
Hydrochloric Acid SCHEMBL8440134 0.92 LSS (0.43) SNCALSSPDE4BKCNH2QRFPR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5998433-A THERAPY FOR HYPERLIPIDEMIA; ATHEROSCLEROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-12-07 US disclosed
EP-0785939-A1 SUBSTITUTED HETEROBICYCLIC ALKYL AMINES AND THEIR USE AS SQUALENE OXIDE CYCLASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 1997-07-30 EP disclosed
WO-1996011201-A1 SUBSTITUTED HETEROBICYCLIC ALKYL AMINES AND THEIR USE AS SQUALENE OXIDE CYCLASE INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-04-18 WO disclosed