SCHEMBL7830563

SCHEMBL7830563

Clc1ccc(C#CCOc2cccc3cccnc23)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.50
NPC1 O15118 4/20 0.50
NPSR1 Q6W5P4 2/20 0.49
ALDH1A1 P00352 2/20 0.49
GAA P10253 2/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 7/20 0.46
KDM4E B2RXH2 8/20 0.46
LMNA P02545 7/20 0.46
HPGD P15428 3/20 0.46
HTT P42858 2/20 0.46
SMN1; SMN2 Q16637 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GRM5 P41594 1/20 0.42

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
SCHEMBL7832027 0.86 LMNA (0.49) RAB9ANPC1NPSR1ALDH1A1GAA
SCHEMBL7819253 0.86 LMNA (0.50) RAB9ANPC1NPSR1ALDH1A1GAA
SCHEMBL7830921 0.85 LMNA (0.50) RAB9ANPC1NPSR1ALDH1A1GAA
SCHEMBL7819362 0.82 LMNA (0.52) RAB9ANPC1NPSR1ALDH1A1GAA
SCHEMBL7820036 0.82 RAB9A (0.59) RAB9ANPC1GAAPOLBMAPT
SCHEMBL6222546 0.81 RAB9A (0.60) RAB9ANPC1GAAPOLBMAPT
SCHEMBL7830618 0.81 RAB9A (0.52) RAB9ANPC1NPSR1ALDH1A1GAA
SCHEMBL7826384 0.81 KDM4E (0.51) RAB9ANPC1NPSR1ALDH1A1GAA
SCHEMBL7830964 0.81 MAPT (0.50) RAB9ANPC1NPSR1ALDH1A1GAA
SCHEMBL7834273 0.80 RAB9A (0.59) RAB9ANPC1NPSR1ALDH1A1GAA

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