SCHEMBL10663156

SCHEMBL10663156

O=C1CCc2c(c(Cl)cc(Cl)c2OCC(O)CN2CCN(c3ccccc3)CC2)N1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.54
KMT2A Q03164 3/20 0.53
MAPK1 P28482 2/20 0.53
GAA P10253 1/20 0.53
MAPT P10636 9/20 0.51
HTR7 P34969 2/20 0.49
RECQL P46063 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
MEN1 O00255 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
SCN1A P35498 1/20 0.47
SCN5A Q14524 1/20 0.47
SCN9A Q15858 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
TP53 P04637 1/20 0.46

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 SCHEMBL10575573 0.99 MAPK1 (0.54) KCNH2KMT2AMAPK1GAAMAPT
SCHEMBL10571685 0.85 KCNH2 (0.56) KCNH2KMT2AMAPK1GAAMAPT
SCHEMBL11071393 0.85 SCN1A (0.49) KCNH2SCN1ASCN5ASCN9A
SCHEMBL10569047 0.83 DRD2 (0.50) HTR7
SCHEMBL10572916 0.79 KCNH2 (0.58) KCNH2KMT2AMAPK1GAAMAPT
SCHEMBL10570913 0.78 KCNH2 (0.62) KCNH2KMT2AMAPK1MAPTHTR7
SCHEMBL11476354 0.78 TSHR (0.54) KCNH2KMT2AMAPK1GAAMAPT
SCHEMBL11486208 0.78 MAPT (0.50) KCNH2KMT2AMAPK1GAAMAPT
SCHEMBL10571929 0.78 SCN5A (0.68) KCNH2KMT2AMAPK1GAAMAPT
Hydrochloric Acid SCHEMBL10572468 0.77 KCNH2 (0.61) KCNH2KMT2AMAPK1MAPTHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4734416-A ANTIHISTAMINES, CENTRAL NERVOUS SYSTEM CONTROLLING ACTION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-03-29 US disclosed