SCHEMBL31238508

SCHEMBL31238508

N#Cc1ccc(Oc2ccc(-c3cc(=O)c4cc(O)ccc4o3)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.66
▸ NPC1 O15118 4/20 0.66
▸ RAB9A P51151 4/20 0.66
▸ CSNK2A2 P19784 4/20 0.66
▸ CSNK2B P67870 4/20 0.66
▸ CSNK2A1 P68400 4/20 0.66
▸ MEN1 O00255 4/20 0.66
▸ KMT2A Q03164 4/20 0.66
▸ NFKB1 P19838 2/20 0.66
▸ NFKB2 Q00653 2/20 0.66
▸ RELA Q04206 2/20 0.66
▸ RECQL P46063 1/20 0.66
▸ CYP3A4 P08684 7/20 0.65
▸ TP53 P04637 6/20 0.65
▸ HPGD P15428 5/20 0.65
▸ SMN1; SMN2 Q16637 4/20 0.65
▸ IP6K2 Q9UHH9 2/20 0.65
▸ LMNA P02545 2/20 0.65
▸ THRB P10828 2/20 0.65
▸ ALOX15 P16050 1/20 0.65

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
SCHEMBL31238531 0.86 MAPT (0.72) MAPTNPC1RAB9ACSNK2A2CSNK2B
SCHEMBL31238451 0.85 MAPT (0.77) MAPTNPC1RAB9ACSNK2A2CSNK2B
SCHEMBL312312 0.85 MAPT (0.71) MAPTNPC1RAB9ACSNK2A2CSNK2B
SCHEMBL31238524 0.84 MAPT (0.92) MAPTNPC1RAB9ACSNK2A2CSNK2B
SCHEMBL31238514 0.84 MAPT (0.70) MAPTNPC1RAB9ACSNK2A2CSNK2B
SCHEMBL31238397 0.82 CSNK2A2 (0.72) MAPTNPC1RAB9ACSNK2A2CSNK2B
SCHEMBL31238453 0.82 MAPT (0.67) MAPTNPC1RAB9ACSNK2A2CSNK2B
SCHEMBL31238500 0.82 MAPT (0.67) MAPTNPC1RAB9ACSNK2A2CSNK2B
SCHEMBL31238372 0.81 MAPT (0.70) MAPTNPC1RAB9ACSNK2A2CSNK2B
SCHEMBL311405 0.80 MAPT (1.00) MAPTNPC1RAB9ACSNK2A2CSNK2B

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
WO-2024189504-A1 BROAD - SPECTRUM ANTI VIRAL COMPOUNDS FOUNDATION FOR NEGLECTED DISEASE RESEARCH (IN) 2024-09-19 — — WO claimed
WO-2024189504-A1 BROAD - SPECTRUM ANTI VIRAL COMPOUNDS FOUNDATION FOR NEGLECTED DISEASE RESEARCH (IN) 2024-09-19 — — WO disclosed
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