SCHEMBL9516889

SCHEMBL9516889

COc1ccc(C=Cc2nc3ccccc3s2)cc1N

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.66
KMT2A Q03164 7/20 0.66
MEN1 O00255 6/20 0.66
KDM4E B2RXH2 4/20 0.66
ALDH1A1 P00352 4/20 0.66
RAB9A P51151 3/20 0.66
HTT P42858 3/20 0.66
GAA P10253 2/20 0.66
POLB P06746 1/20 0.66
APP P05067 3/20 0.56
SMN1; SMN2 Q16637 5/20 0.54
INSR P06213 1/20 0.54
NCOA1 Q15788 1/20 0.54
NPC1 O15118 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C19 P33261 1/20 0.51
TUBB4A P04350 2/20 0.50

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
SCHEMBL9516881 1.00 MAPT (0.66) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL2526639 0.88 MAPT (0.74) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL2526641 0.88 MAPT (0.74) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL2830702 0.85 MAPT (0.73) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL23111697 0.82 MAPT (0.77) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL19695963 0.82 MAPT (0.77) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL9515558 0.81 SNCA (0.60) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL9515572 0.81 SNCA (0.60) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL17576070 0.81 MAPT (0.79) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL16180704 0.81 MAPT (0.79) MAPTKMT2AMEN1KDM4EALDH1A1

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