SCHEMBL20054859

SCHEMBL20054859

C=C(C)C(=O)Nc1ccc(CCC(=O)N2CCC2=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.45
RXFP1 Q9HBX9 1/20 0.42
MAPT P10636 2/20 0.40
NPC1 O15118 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 2/20 0.39
RECQL P46063 2/20 0.39
BLM P54132 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
FGFR1 P11362 1/20 0.39
FGFR4 P22455 1/20 0.39
HPGD P15428 2/20 0.38
ITGB1 P05556 1/20 0.38
ITGA4 P13612 1/20 0.38
ALOX15 P16050 1/20 0.38
ALDH1A1 P00352 3/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL14297019 0.87 POLB (0.49) POLBMAPTNPC1MAPK1RAB9A
SCHEMBL14297018 0.82 POLB (0.67) POLBMAPTNPC1MAPK1RAB9A
SCHEMBL20196333 0.82 POLB (0.45) POLBMAPTNPC1MAPK1RAB9A
SCHEMBL20054835 0.81 POLB (0.46) POLBMAPTNPC1MAPK1RAB9A
SCHEMBL20054903 0.81 POLB (0.46) POLBRXFP1MAPTNPC1MAPK1
SCHEMBL23615473 0.81 HDAC3 (0.58) POLBMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL19647099 0.81 L3MBTL1 (0.47) POLBMAPTNPC1MAPK1RAB9A
SCHEMBL13625388 0.81 POLB (0.51) POLBMAPTNPC1MAPK1RAB9A
SCHEMBL13643864 0.79 POLB (0.47) POLBMAPTNPC1MAPK1RAB9A
SCHEMBL13471907 0.79 THRA (0.49) POLBMAPTNPC1MAPK1RAB9A

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
EP-2780039-B9 CYTOTOXIC PEPTIDES AND ANTIBODY DRUG CONJUGATES THEREOF PFIZER (US) 2018-04-18 EP disclosed