SCHEMBL9712933

SCHEMBL9712933

CCOC(=O)COc1ccc(C=O)cc1NC(=O)c1ccc(OCCCCc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 2/20 0.50
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
LTA4H P09960 7/20 0.46
SCN5A Q14524 2/20 0.45
SCN2A Q99250 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
PLK1 P53350 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
CYSLTR2 Q9NS75 2/20 0.43
CYSLTR1 Q9Y271 2/20 0.43
ABCC4 O15439 1/20 0.43
ABCB11 O95342 1/20 0.43
PGR P06401 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
SCHEMBL9713032 0.90 PLK1 (0.53) NR1H4LMNAPOLBMAPTSCN5A
SCHEMBL9713490 0.90 NR1H4 (0.54) NR1H4SCN5ASCN2ACYSLTR2CYSLTR1
SCHEMBL9857546 0.89 NR1H4 (0.52) NR1H4LMNAPOLBMAPTLTA4H
SCHEMBL9857365 0.89 NR1H4 (0.52) NR1H4LMNAPOLBMAPTSCN5A
SCHEMBL9712980 0.89 NR1H4 (0.54) NR1H4LMNAPOLBMAPTSCN5A
SCHEMBL9713056 0.89 NR1H4 (0.50) NR1H4LMNAPOLBMAPTLTA4H
SCHEMBL9856932 0.89 MAPT (0.52) NR1H4LMNAPOLBMAPTSCN5A
SCHEMBL9857326 0.89 NR1H4 (0.51) NR1H4LMNAPOLBMAPTLTA4H
SCHEMBL9712885 0.89 NR1H4 (0.51) NR1H4LMNAPOLBMAPTLTA4H
SCHEMBL9713720 0.89 NR1H4 (0.51) NR1H4LMNAPOLBMAPTSCN5A

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
US-5140046-A Slow reacting substance of anaphylaxis antagonists YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1992-08-18 US disclosed
US-5116853-A SRS-Antagonist, Antiallergens MASE TOSHIYASU (JP) 1992-05-26 US disclosed
US-4994479-A Antagonists of SRS-A(slow reacting substance of anaphylaxis); antiallergens, antiischemic agents YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-02-19 US disclosed
EP-0218728-A1 PHENYLENE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1987-04-22 EP disclosed
WO-1986005779-A1 PHENYLENE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1986-10-09 WO disclosed