SCHEMBL24512443

SCHEMBL24512443

CNC(=O)c1ccc(NC(=O)SC)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 5/20 0.58
▸ HDAC2 Q92769 1/20 0.53
▸ HDAC8 Q9BY41 1/20 0.53
▸ HDAC6 Q9UBN7 1/20 0.53
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ NPC1 O15118 4/20 0.50
▸ RAB9A P51151 4/20 0.50
▸ HPGD P15428 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ GPR55 Q9Y2T6 1/20 0.48
▸ TP53 P04637 2/20 0.46
▸ CA2 P00918 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ MAPT P10636 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ PKM P14618 1/20 0.46

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
SCHEMBL18019596 0.84 NPC1 (0.69) PLK1HDAC2HDAC8HDAC6SMN1; SMN2
SCHEMBL11774528 0.80 NPC1 (0.59) PLK1HDAC2HDAC8HDAC6SMN1; SMN2
SCHEMBL10153970 0.80 CACNA1B (0.67) HDAC2HDAC8HDAC6SMN1; SMN2NPC1
SCHEMBL22843940 0.80 MAPT (0.59) SMN1; SMN2NPC1RAB9AHPGDHTT
SCHEMBL10155589 0.80 ALDH1A1 (0.62) PLK1HDAC2HDAC8HDAC6SMN1; SMN2
SCHEMBL15798566 0.78 HDAC2 (0.55) PLK1HDAC2HDAC8HDAC6SMN1; SMN2
SCHEMBL250247 0.78 HDAC6 (0.80) PLK1HDAC2HDAC8HDAC6SMN1; SMN2
SCHEMBL8306146 0.77 HDAC2 (0.64) PLK1HDAC2HDAC8HDAC6SMN1; SMN2
SCHEMBL12200275 0.77 RAB9A (0.85) SMN1; SMN2NPC1RAB9AHPGDTP53
SCHEMBL16610324 0.77 CACNA1B (0.73) HDAC2HDAC8HDAC6SMN1; SMN2NPC1

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-2022125673-A1 CELL-PENETRATING PEPTIDES AND PEPTIDE COMPLEXES AND METHODS OF USE FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2022-06-16 — — WO disclosed
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