SCHEMBL9515899

SCHEMBL9515899

O=C(O)c1ccccc1Nc1cccc(C=Cc2nc3ccccc3s2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 2/20 0.49
ALOX5 P09917 1/20 0.48
EPHX2 P34913 1/20 0.48
MAPT P10636 5/20 0.45
KMT2A Q03164 5/20 0.45
KDM4E B2RXH2 4/20 0.45
MEN1 O00255 4/20 0.45
ALDH1A1 P00352 4/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
TAS2R14 Q9NYV8 2/20 0.45
NPC1 O15118 2/20 0.45
LMNA P02545 2/20 0.45
PTGS1 P23219 1/20 0.45
PTGS2 P35354 1/20 0.45
AKR1C3 P42330 1/20 0.45
AKR1C2 P52895 1/20 0.45
TP53 P04637 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45

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
SCHEMBL9515896 1.00 SIRT1 (0.49) SIRT1ALOX5EPHX2MAPTKMT2A
SCHEMBL9642574 0.78 MEN1 (0.52) ALOX5EPHX2MAPTKMT2AKDM4E
SCHEMBL9642572 0.78 MEN1 (0.52) ALOX5EPHX2MAPTKMT2AKDM4E
SCHEMBL9514448 0.77 ALOX5 (0.53) ALOX5EPHX2MAPTKMT2AKDM4E
SCHEMBL9514441 0.77 POLB (0.56) ALOX5EPHX2MAPTKMT2AKDM4E
SCHEMBL9514406 0.77 ALOX5 (0.48) ALOX5EPHX2MAPTKMT2AKDM4E
SCHEMBL10720978 0.77 ALOX5 (0.48) ALOX5EPHX2MAPTKMT2AKDM4E
SCHEMBL12880505 0.76 PTPN1 (0.59) ALOX5EPHX2MAPTKMT2AKDM4E
SCHEMBL9518116 0.75 ALOX5 (0.46) ALOX5EPHX2MAPTKMT2AKDM4E
SCHEMBL9518105 0.75 ALOX5 (0.46) ALOX5EPHX2MAPTKMT2AKDM4E

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-0219436-B1 Thiazole derivative and leukotriene antagonist containing the same as the effective ingredients MITSUBISHI CHEM IND (JP) 1993-12-22 EP disclosed
US-4902700-A Thiazole derivative and leukotriene antagonist containing the same as the effective ingredients MITSUBISHI KASEI CORPORATION (JP) 1990-02-20 US disclosed
EP-0219436-A2 Thiazole derivative and leukotriene antagonist containing the same as the effective ingredients MITSUBISHI KASEI CORPORATION (JP) 1987-04-22 EP disclosed