SCHEMBL3655499

SCHEMBL3655499

O=C(O)c1ccc(-c2ccc(CC=NNc3nc4ccccc4s3)s2)o1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 9/20 0.51
▸ NPC1 O15118 8/20 0.51
▸ KDM4E B2RXH2 5/20 0.51
▸ ATM Q13315 1/20 0.51
▸ MAPT P10636 10/20 0.47
▸ GAA P10253 9/20 0.47
▸ SMN1; SMN2 Q16637 7/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ KMT2A Q03164 7/20 0.42
▸ MEN1 O00255 6/20 0.42
▸ NFKB1 P19838 4/20 0.42
▸ NFKB2 Q00653 4/20 0.42
▸ RELA Q04206 4/20 0.42
▸ LMNA P02545 2/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ CSNK1D P48730 2/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ POLB P06746 2/20 0.40

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
SCHEMBL3777067 0.85 MAPT (0.52) RAB9ANPC1KDM4EMAPTGAA
SCHEMBL3648116 0.83 BCL2L1 (0.49) RAB9ANPC1KDM4EATMMAPT
SCHEMBL3012995 0.80 MAPT (0.58) RAB9ANPC1KDM4EATMMAPT
SCHEMBL3013006 0.80 MAPT (0.58) RAB9ANPC1KDM4EATMMAPT
SCHEMBL3651313 0.79 RAB9A (0.47) RAB9ANPC1KDM4EMAPTGAA
SCHEMBL3655494 0.78 RAB9A (0.44) RAB9ANPC1KDM4EATMMAPT
SCHEMBL3655217 0.73 SMN1; SMN2 (0.47) RAB9ANPC1KDM4EMAPTGAA
SCHEMBL3649157 0.72 GAA (0.54) RAB9ANPC1KDM4EMAPTGAA
SCHEMBL3652381 0.72 MAPT (0.44) RAB9ANPC1KDM4EMAPTGAA
SCHEMBL3655308 0.72 GAA (0.44) RAB9ANPC1KDM4EMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2193127-A1 BENZOTHIAZOLE COMPOUNDS The Walter and Eliza Hall Institute of Medical Research (AU) 2010-06-09 — — EP disclosed
WO-2009039553-A1 BENZOTHIAZOLE COMPOUNDS THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2009-04-02 — — WO disclosed
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