SCHEMBL7280491

SCHEMBL7280491

NC(=O)C(c1ccc(Cl)cc1)N1CCN(CC(O)COc2ccccc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.60
KMT2A Q03164 3/20 0.59
MEN1 O00255 2/20 0.59
KCNH2 Q12809 2/20 0.56
CACNA1G O43497 1/20 0.56
HTT P42858 1/20 0.55
KDM4E B2RXH2 1/20 0.55
RECQL P46063 1/20 0.54
CYP2D6 P10635 7/20 0.54
TSHR P16473 1/20 0.54
HIF1A Q16665 1/20 0.54
DRD4 P21917 1/20 0.53
LMNA P02545 2/20 0.52
ALDH1A1 P00352 2/20 0.52
MAPK1 P28482 1/20 0.52
MAPT P10636 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HTR7 P34969 1/20 0.52

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
SCHEMBL7281720 0.94 KCNH2 (0.62) KMT2AKCNH2CACNA1GKDM4ERECQL
SCHEMBL7288432 0.92 MEN1 (0.69) L3MBTL1KMT2AMEN1HTTKDM4E
SCHEMBL7288616 0.89 CYP2D6 (0.65) L3MBTL1KMT2AMEN1HTTKDM4E
SCHEMBL10837247 0.89 KMT2A (0.58) L3MBTL1KMT2AMEN1CACNA1GHTT
SCHEMBL10835709 0.88 CYP2D6 (0.66) L3MBTL1KMT2AMEN1KDM4ECYP2D6
SCHEMBL7289205 0.86 CYP2D6 (0.54) KMT2AMEN1KCNH2HTTKDM4E
SCHEMBL7288741 0.85 USP2 (0.65) L3MBTL1KMT2AMEN1HTTCYP2D6
SCHEMBL7288797 0.85 CYP2D6 (0.65) L3MBTL1KMT2AMEN1KDM4ECYP2D6
SCHEMBL7288820 0.83 CYP2D6 (0.64) L3MBTL1KMT2AMEN1KDM4ECYP2D6
SCHEMBL7282602 0.82 MEN1 (0.56) L3MBTL1KMT2AMEN1HTTCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4567264-A ADRENERGIC BLOCKING AGENTS SYNTEX (U.S.A.) INC. (US) 1986-01-28 US disclosed
EP-0126449-A1 Cardioselective aryloxy- and arylthio-hydroxypropyl piperazinyl acetanilides wich affect calcium entry SYNTEX (U.S.A.) INC. (US) 1984-11-28 EP disclosed