SCHEMBL7819953

SCHEMBL7819953

O=[N+]([O-])c1cccc(C#CCOc2cccc3cccnc23)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.56
KMT2A Q03164 6/20 0.56
NPC1 O15118 2/20 0.56
MAPT P10636 6/20 0.55
KDM4E B2RXH2 3/20 0.55
NPSR1 Q6W5P4 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
ALDH1A1 P00352 3/20 0.54
HTT P42858 2/20 0.54
GAA P10253 2/20 0.54
MAPK1 P28482 1/20 0.54
RAB9A P51151 4/20 0.50
LMNA P02545 2/20 0.48
PDE4D Q08499 3/20 0.48
GRM5 P41594 1/20 0.46
KDR P35968 1/20 0.44
CHRM2 P08172 1/20 0.44
CHRM1 P11229 1/20 0.44
PSMD14 O00487 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL7833737 0.88 MEN1 (0.65) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL6222546 0.80 RAB9A (0.60) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL7832027 0.80 LMNA (0.49) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL7826384 0.80 KDM4E (0.51) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL7830618 0.80 RAB9A (0.52) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL9068246 0.79 RAB9A (0.49) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL4557117 0.78 GRM5 (0.52) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL9447009 0.77 KMT2A (0.77) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL7820255 0.77 MAPT (0.62) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL7819492 0.77 RAB9A (0.44) MEN1KMT2ANPC1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0764165-B1 PREPARATION OF STEREOCHEMICALLY PURE OXIMES WITH MUSCARINIC ACTIVITY WARNER LAMBERT CO (US) 2001-11-07 EP claimed
US-5346911-A Analgesics, cognition activators, treatment of alzheimer*s s disease WARNER-LAMBERT COMPANY (US) 1994-09-13 US claimed
EP-0764165-B1 PREPARATION OF STEREOCHEMICALLY PURE OXIMES WITH MUSCARINIC ACTIVITY WARNER LAMBERT CO (US) 2001-11-07 EP disclosed
US-5514812-A Preparation of stereochemically pure oximes with muscarinic activity WARNER-LAMBERT COMPANY (US) 1996-05-07 US disclosed
US-5346911-A Analgesics, cognition activators, treatment of alzheimer*s s disease WARNER-LAMBERT COMPANY (US) 1994-09-13 US disclosed