SCHEMBL7796736

SCHEMBL7796736

CN1C(Cl)=C(Cl)CC1C(=O)N1CCc2cc(C(=O)NO)sc2C1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 13/20 0.60
▸ WDR91 A4D1P6 1/20 0.41
▸ MCHR1 Q99705 1/20 0.39
▸ KDM1A O60341 4/20 0.37
▸ ALDH1A1 P00352 3/20 0.35
▸ POLB P06746 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ F10 P00742 1/20 0.35
▸ TP53 P04637 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ BRD4 O60885 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.33

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
SCHEMBL7796842 0.92 HDAC6 (0.60) HDAC6MCHR1KDM1AALDH1A1POLB
SCHEMBL7787392 0.80 HDAC6 (0.61) HDAC6WDR91MCHR1KDM1AALDH1A1
SCHEMBL7787923 0.76 HDAC6 (0.57) HDAC6WDR91MCHR1KDM1AALDH1A1
SCHEMBL1174257 0.75 HDAC6 (1.00) HDAC6ALDH1A1POLBPKM
SCHEMBL1173937 0.74 HDAC6 (0.80) HDAC6KDM1A
SCHEMBL7797020 0.74 HDAC6 (0.57) HDAC6WDR91MCHR1KDM1AALDH1A1
SCHEMBL1174246 0.73 HDAC6 (1.00) HDAC6WDR91KDM1AALDH1A1POLB
SCHEMBL1173867 0.73 HDAC6 (0.66) HDAC6WDR91MCHR1KDM1AALDH1A1
SCHEMBL7795830 0.73 HDAC6 (0.64) HDAC6WDR91MCHR1KDM1AALDH1A1
SCHEMBL7787425 0.71 HDAC6 (0.55) HDAC6WDR91MCHR1ALDH1A1TP53

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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