SCHEMBL9491986

SCHEMBL9491986

O=Cc1cccc2c(CCCCCc3ccccc3)cccc12

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BID P55957 1/20 0.47
BCL2L1 Q07817 1/20 0.47
MCL1 Q07820 1/20 0.47
BAK1 Q16611 1/20 0.47
SIGMAR1 Q99720 9/20 0.43
MAPT P10636 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
CDK1 P06493 1/20 0.38
TRPV1 Q8NER1 2/20 0.38
CYSLTR2 Q9NS75 1/20 0.38
CYSLTR1 Q9Y271 1/20 0.38
MAOA P21397 1/20 0.38
ACHE P22303 1/20 0.38
SGMS1 Q86VZ5 1/20 0.38
SGMS2 Q8NHU3 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38

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
SCHEMBL13277570 0.92 SIGMAR1 (0.44) BIDBCL2L1MCL1BAK1SIGMAR1
SCHEMBL13469710 0.90 SIGMAR1 (0.42) BIDBCL2L1MCL1BAK1SIGMAR1
SCHEMBL7091261 0.85 SIGMAR1 (0.50) BIDBCL2L1MCL1BAK1SIGMAR1
SCHEMBL11476341 0.81 LIPG (0.45) BIDBCL2L1MCL1BAK1MAPT
SCHEMBL9142138 0.78 SIGMAR1 (0.50) SIGMAR1MAPTRXFP1CDK1MAOA
SCHEMBL13278118 0.77 HDAC1 (0.48) SIGMAR1MAPTRXFP1ACHEMTNR1A
SCHEMBL8935957 0.76 GPR84 (0.58) BIDBCL2L1MCL1BAK1SIGMAR1
SCHEMBL9301480 0.76 GPR84 (0.58) BIDBCL2L1MCL1BAK1SIGMAR1
SCHEMBL13617878 0.76 LIPG (0.47) MAPT
SCHEMBL28644178 0.76 LIPG (0.47) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0527175-A4 3-NAPHTHYL-3-CARBOXYALKYLTHIO OR OXY SUBSTITUTED ALKANOIC ACID LEUKOTRIENE ANTAGONISTS 1993-05-05 EP disclosed
EP-0527175-A1 3-NAPHTHYL-3-CARBOXYALKYLTHIO OR OXY SUBSTITUTED ALKANOIC ACID LEUKOTRIENE ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1993-02-17 EP disclosed
WO-1991017149-A1 3-NAPHTHYL-3-CARBOXYALKYLTHIO OR OXY SUBSTITUTED ALKANOIC ACID LEUKOTRIENE ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1991-11-14 WO disclosed