SCHEMBL7796842

SCHEMBL7796842

CN1C(Cl)=C(Cl)CC1C(=O)N1CCc2sc(C(=O)NO)cc2C1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 13/20 0.60
▸ KDM1A O60341 5/20 0.44
▸ MCHR1 Q99705 1/20 0.39
▸ PRMT5 O14744 4/20 0.37
▸ WDR77 Q9BQA1 4/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ POLB P06746 1/20 0.35
▸ PKM P14618 1/20 0.35

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
SCHEMBL7796736 0.92 HDAC6 (0.60) HDAC6KDM1AMCHR1ALDH1A1POLB
SCHEMBL1173763 0.75 HDAC6 (1.00) HDAC6KDM1A
SCHEMBL1173977 0.73 HDAC6 (1.00) HDAC6KDM1APRMT5WDR77ALDH1A1
SCHEMBL1173979 0.73 HDAC6 (0.66) HDAC6KDM1APRMT5WDR77
SCHEMBL1174513 0.73 HDAC6 (0.72) HDAC6KDM1APRMT5WDR77
SCHEMBL1174506 0.72 HDAC6 (0.61) HDAC6KDM1APRMT5WDR77
SCHEMBL28527971 0.71 HDAC6 (0.55) HDAC6KDM1AMCHR1PRMT5WDR77
SCHEMBL7787392 0.71 HDAC6 (0.61) HDAC6KDM1AMCHR1ALDH1A1POLB
SCHEMBL28527972 0.71 HDAC6 (0.55) HDAC6KDM1AMCHR1PRMT5WDR77
SCHEMBL12883097 0.71 HDAC6 (0.55) HDAC6KDM1AMCHR1PRMT5WDR77

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
WO-2010151317-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-12-29 — — WO disclosed
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