SCHEMBL7832027

SCHEMBL7832027

Clc1cccc(C#CCOc2cccc3cccnc23)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 8/20 0.49
MAPT P10636 7/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
HPGD P15428 3/20 0.49
ALDH1A1 P00352 2/20 0.49
HTT P42858 2/20 0.49
RAB9A P51151 5/20 0.48
NPC1 O15118 4/20 0.48
GAA P10253 3/20 0.47
NPSR1 Q6W5P4 2/20 0.47
POLB P06746 1/20 0.47
KDM4E B2RXH2 8/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
L3MBTL1 Q9Y468 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
SCHEMBL7830921 0.91 LMNA (0.50) LMNAMAPTSMN1; SMN2HPGDALDH1A1
SCHEMBL7819253 0.87 LMNA (0.50) LMNAMAPTSMN1; SMN2HPGDALDH1A1
SCHEMBL7830563 0.86 RAB9A (0.50) LMNAMAPTSMN1; SMN2HPGDALDH1A1
SCHEMBL6222546 0.85 RAB9A (0.60) LMNAMAPTSMN1; SMN2RAB9ANPC1
SCHEMBL7830618 0.85 RAB9A (0.52) LMNAMAPTSMN1; SMN2HPGDALDH1A1
SCHEMBL7826384 0.85 KDM4E (0.51) LMNAMAPTSMN1; SMN2HPGDALDH1A1
SCHEMBL4557117 0.82 GRM5 (0.52) LMNAMAPTSMN1; SMN2HPGDALDH1A1
SCHEMBL9068246 0.82 RAB9A (0.49) LMNAMAPTSMN1; SMN2RAB9ANPC1
SCHEMBL7820255 0.81 MAPT (0.62) LMNAMAPTSMN1; SMN2HPGDALDH1A1
SCHEMBL7819492 0.81 RAB9A (0.44) LMNAMAPTSMN1; SMN2ALDH1A1RAB9A

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 11 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
EP-0608336-B1 AZABICYCLO ARYLACETYLENE AND ARYLENYNE OXIMES AS CHOLINERGIC AGENTS AND METHODS OF TREATMENT WARNER LAMBERT CO (US) 1998-05-20 EP claimed
US-5346911-A Analgesics, cognition activators, treatment of alzheimer*s s disease WARNER-LAMBERT COMPANY (US) 1994-09-13 US claimed
EP-0608336-A1 AZABICYCLO ARYLACETYLENE AND ARYLENYNE OXIMES AS CHOLINERGIC AGENTS AND METHODS OF TREATMENT WARNER-LAMBERT COMPANY (US) 1994-08-03 EP claimed
WO-1993008192-A1 AZABICYCLO ARYLACETYLENE AND ARYLENYNE OXIMES AS CHOLINERGIC AGENTS AND METHODS OF TREATMENT WARNER-LAMBERT COMPANY (US) 1993-04-29 WO claimed
EP-0764165-B1 PREPARATION OF STEREOCHEMICALLY PURE OXIMES WITH MUSCARINIC ACTIVITY WARNER LAMBERT CO (US) 2001-11-07 EP disclosed
EP-0608336-B1 AZABICYCLO ARYLACETYLENE AND ARYLENYNE OXIMES AS CHOLINERGIC AGENTS AND METHODS OF TREATMENT WARNER LAMBERT CO (US) 1998-05-20 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
EP-0608336-A1 AZABICYCLO ARYLACETYLENE AND ARYLENYNE OXIMES AS CHOLINERGIC AGENTS AND METHODS OF TREATMENT WARNER-LAMBERT COMPANY (US) 1994-08-03 EP disclosed
WO-1993008192-A1 AZABICYCLO ARYLACETYLENE AND ARYLENYNE OXIMES AS CHOLINERGIC AGENTS AND METHODS OF TREATMENT WARNER-LAMBERT COMPANY (US) 1993-04-29 WO disclosed