SCHEMBL9515980

SCHEMBL9515980

CCOC(=O)COc1cccc(/C=C/c2nc3ccccc3s2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.53
CYSLTR1 Q9Y271 2/20 0.53
MAPT P10636 4/20 0.51
KDM4E B2RXH2 4/20 0.51
KMT2A Q03164 3/20 0.51
ALDH1A1 P00352 2/20 0.51
HTT P42858 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
LMNA P02545 1/20 0.51
HPGD P15428 1/20 0.51
MEN1 O00255 2/20 0.48
GAA P10253 2/20 0.48
POLB P06746 1/20 0.48
RAB9A P51151 1/20 0.48
ATP4A P20648 10/20 0.48
ATP4B P51164 10/20 0.48
NPC1 O15118 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47

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
SCHEMBL9515993 1.00 CYSLTR2 (0.53) CYSLTR2CYSLTR1MAPTKDM4EKMT2A
SCHEMBL9516834 0.89 CYSLTR2 (0.67) CYSLTR2CYSLTR1MAPTKDM4EKMT2A
SCHEMBL9516841 0.89 CYSLTR2 (0.67) CYSLTR2CYSLTR1MAPTKDM4EKMT2A
SCHEMBL22472257 0.82 MEN1 (0.53) MAPTKDM4EKMT2AALDH1A1HTT
SCHEMBL9518053 0.81 CYSLTR2 (0.57) CYSLTR2CYSLTR1MAPTKDM4EKMT2A
SCHEMBL9518047 0.81 CYSLTR2 (0.57) CYSLTR2CYSLTR1MAPTKDM4EKMT2A
SCHEMBL14743620 0.80 MAPT (0.63) MAPTKDM4EKMT2ASMN1; SMN2LMNA
SCHEMBL9515569 0.79 L3MBTL1 (0.48) CYSLTR2CYSLTR1MAPTKDM4EKMT2A
SCHEMBL9515581 0.78 ATP4A (0.55) ATP4AATP4B
SCHEMBL9515591 0.78 ATP4A (0.55) ATP4AATP4B

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