SCHEMBL11605659

SCHEMBL11605659

Cc1ccc2sc(Sc3ccc(Sc4nc5cc(C)ccc5s4)c4c3C(=O)c3c(Sc5nc6cc(C)ccc6s5)ccc(Sc5nc6cc(C)ccc6s5)c3C4=O)nc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 1/20 0.43
▸ MAPT P10636 5/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ LMNA P02545 3/20 0.41
▸ TP53 P04637 2/20 0.41
▸ HTT P42858 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ JAK2 O60674 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ TDP1 Q9NUW8 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ GAA P10253 2/20 0.37
▸ HSP90AA1 P07900 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CTSD P07339 1/20 0.36

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
SCHEMBL11601529 0.83 SMN1; SMN2 (0.57) MAPTSMN1; SMN2KMT2ANPSR1MEN1
SCHEMBL11603794 0.80 PPARA (0.39) MAPTSMN1; SMN2KMT2ALMNATP53
SCHEMBL11603724 0.80 ALOX5 (0.47) DYRK1AMAPTSMN1; SMN2KMT2ALMNA
SCHEMBL11602024 0.79 ALDH1A1 (0.56) MAPTSMN1; SMN2KMT2ALMNATP53
SCHEMBL11606470 0.78 SMN1; SMN2 (0.41) MAPTSMN1; SMN2KMT2ALMNATP53
SCHEMBL11604954 0.77 SMN1; SMN2 (0.50) MAPTSMN1; SMN2KMT2ALMNATP53
SCHEMBL1772108 0.76 PDK1 (0.55) DYRK1AMAPTSMN1; SMN2LMNATP53
SCHEMBL11603253 0.74 PPARA (0.50) DYRK1AMAPTSMN1; SMN2KMT2ALMNA
SCHEMBL11605260 0.74 KMT2A (0.58) MAPTSMN1; SMN2KMT2ALMNATP53
SCHEMBL11601837 0.74 PPARA (0.45) MAPTSMN1; SMN2KMT2ALMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4096111-A (BENZOTHIAZOLYL-THIO)-SUBSTITUTED ANTHRAQUINONES BAYER AKTIENGESELLSCHAFT (DT) 1978-06-20 — — US disclosed
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