SCHEMBL7956967

SCHEMBL7956967

Cc1cc(Br)cc(C)c1OC[C@@H]1CCCNC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.48
PIM2 Q9P1W9 1/20 0.48
MAP2K1 Q02750 1/20 0.42
KDM1A O60341 1/20 0.41
SCN9A Q15858 1/20 0.40
EED O75530 1/20 0.39
SLC6A2 P23975 3/20 0.39
SLC6A4 P31645 3/20 0.39
SLC6A3 Q01959 1/20 0.39
FEN1 P39748 1/20 0.39
IKBKB O14920 1/20 0.38
CHUK O15111 1/20 0.38
SYK P43405 2/20 0.38
AURKB Q96GD4 2/20 0.38
CHRNB2 P17787 1/20 0.38
CHRNA4 P43681 1/20 0.38
BRD4 O60885 1/20 0.37
ATAD2 Q6PL18 1/20 0.37
KCNH2 Q12809 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36

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
SCHEMBL7241234 1.00 PIM1 (0.48) PIM1PIM2MAP2K1KDM1ASCN9A
SCHEMBL7241236 1.00 PIM1 (0.48) PIM1PIM2MAP2K1KDM1ASCN9A
Hydrochloric Acid SCHEMBL7956943 0.99 PIM1 (0.47) PIM1PIM2MAP2K1KDM1ASCN9A
Hydrochloric Acid SCHEMBL7953424 0.99 PIM1 (0.47) PIM1PIM2MAP2K1KDM1ASCN9A
SCHEMBL27504553 0.86 MAP2K1 (0.42) PIM1PIM2MAP2K1KDM1ASCN9A
SCHEMBL14578267 0.86 EED (0.42) PIM1PIM2MAP2K1KDM1ASCN9A
SCHEMBL14578094 0.84 MAP2K1 (0.41) PIM1PIM2MAP2K1KDM1ASCN9A
Hydrochloric Acid SCHEMBL7953506 0.84 MAP2K1 (0.41) PIM1PIM2MAP2K1KDM1ASCN9A
SCHEMBL27504233 0.82 EED (0.47) PIM1PIM2MAP2K1KDM1AEED
SCHEMBL27487413 0.82 EED (0.47) PIM1PIM2MAP2K1KDM1AEED

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6262078-B1 Phenoxymethyl piperidine derivatives for the treatment of neuropathic pain SYNTEX (U.S.A.) LLC 2001-07-17 US disclosed
US-6110937-A A SODIUM CHANNEL BLOCKER TREATING AS LOCAL ANESTHETICS AND IN THE TREATMENT OF CARDIAC ARRHYTHMIAS SYNTEX USA, INC. (US) 2000-08-29 US disclosed
EP-0869119-A1 Phenoxymethyl piperidine derivatives being sodium channle blockers F. HOFFMANN-LA ROCHE AG (CH) 1998-10-07 EP disclosed
CN-1194977-A Phenoxymethyl piperidine derivatives HOFFMANN LA ROCHE (CH) 1998-10-07 CN disclosed