SCHEMBL10359737

SCHEMBL10359737

CC(=O)N1CCN(c2cc(F)ccc2[N+](=O)[O-])CC1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.65
ALDH1A1 P00352 9/20 0.65
GPR174 Q9BXC1 2/20 0.64
NPSR1 Q6W5P4 4/20 0.57
LMNA P02545 4/20 0.57
SMN1; SMN2 Q16637 4/20 0.54
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
HTT P42858 3/20 0.53
TP53 P04637 1/20 0.50
NPC1 O15118 1/20 0.49
RECQL P46063 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL5989854 0.89 MAPT (0.72) MAPTALDH1A1GPR174NPSR1LMNA
SCHEMBL30783741 0.84 MAPT (0.56) MAPTALDH1A1GPR174NPSR1LMNA
SCHEMBL957198 0.84 MAPT (0.61) MAPTALDH1A1GPR174NPSR1LMNA
SCHEMBL3317301 0.83 MAPT (0.81) MAPTALDH1A1GPR174NPSR1LMNA
SCHEMBL5322795 0.83 ALDH1A1 (0.64) MAPTALDH1A1NPSR1LMNASMN1; SMN2
SCHEMBL23884700 0.83 MAPT (0.59) MAPTALDH1A1GPR174LMNASMN1; SMN2
SCHEMBL22471138 0.82 MAPT (0.62) MAPTALDH1A1GPR174NPSR1LMNA
SCHEMBL28038246 0.81 ALDH1A1 (0.69) MAPTALDH1A1NPSR1LMNASMN1; SMN2
SCHEMBL12890005 0.80 GRM5 (0.62) MAPTALDH1A1GPR174LMNASMN1; SMN2
SCHEMBL16823203 0.80 MAPT (0.48) MAPTALDH1A1GPR174NPSR1LMNA

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
EP-0257864-B1 ANTIARRHYTHMIC AGENTS Pfizer Limited (GB) 1990-12-05 EP disclosed
US-4797401-A 4-Substituted-1-(4-alkylsulphonamidophenyl)piperazines as antiarrhythmic agents PFIZER INC. (US) 1989-01-10 US disclosed