SCHEMBL7820076

SCHEMBL7820076

CCOc1ccc(C#CCOc2cccc3cccnc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.56
LMNA P02545 6/20 0.56
MAPT P10636 5/20 0.56
RAB9A P51151 4/20 0.50
KMT2A Q03164 5/20 0.46
POLB P06746 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
HTT P42858 1/20 0.44
CCR6 P51684 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 4/20 0.44
NPC1 O15118 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 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
SCHEMBL6217256 0.90 MAPT (0.50) KDM4ELMNAMAPTRAB9AKMT2A
SCHEMBL7820255 0.89 MAPT (0.62) KDM4ELMNAMAPTRAB9AKMT2A
SCHEMBL7830964 0.87 MAPT (0.50) KDM4ELMNAMAPTRAB9AKMT2A
SCHEMBL7820036 0.85 RAB9A (0.59) KDM4ELMNAMAPTRAB9AKMT2A
SCHEMBL6222546 0.85 RAB9A (0.60) KDM4ELMNAMAPTRAB9AKMT2A
SCHEMBL7819253 0.84 LMNA (0.50) KDM4ELMNAMAPTRAB9AKMT2A
SCHEMBL7831393 0.81 RAB9A (0.46) KDM4ELMNAMAPTRAB9AKMT2A
SCHEMBL7819362 0.81 LMNA (0.52) KDM4ELMNAMAPTRAB9AKMT2A
SCHEMBL4557117 0.80 GRM5 (0.52) KDM4ELMNAMAPTRAB9AKMT2A
SCHEMBL7826384 0.80 KDM4E (0.51) KDM4ELMNAMAPTRAB9AKMT2A

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