SCHEMBL23367279

SCHEMBL23367279

O=CC(C=O)=NNc1ccc(Cl)cc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.45
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 2/20 0.41
HPGD P15428 1/20 0.41
MEN1 O00255 4/20 0.40
MAPT P10636 5/20 0.40
ALDH1A1 P00352 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
POLB P06746 1/20 0.40
ALOX12 P18054 1/20 0.40
RXFP1 Q9HBX9 2/20 0.39
PKM P14618 1/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HTT P42858 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL23367285 0.85 CA1 (0.42) KMT2ARAB9ANPC1SMN1; SMN2LMNA
SCHEMBL23367425 0.83 ALDH1A1 (0.57) KMT2ARAB9ANPC1SMN1; SMN2LMNA
SCHEMBL23354938 0.81 KMT2A (0.44) KMT2ARAB9ANPC1SMN1; SMN2LMNA
SCHEMBL518882 0.78 KMT2A (0.47) KMT2ARAB9ANPC1SMN1; SMN2LMNA
SCHEMBL23354723 0.75 MAPK1 (0.44) KMT2ARAB9ANPC1SMN1; SMN2LMNA
SCHEMBL23384997 0.74 MEN1 (0.45) KMT2ARAB9ANPC1SMN1; SMN2LMNA
SCHEMBL31312715 0.74 KMT2A (0.43) KMT2ARAB9ANPC1SMN1; SMN2LMNA
SCHEMBL23367274 0.74 KMT2A (0.47) KMT2ASMN1; SMN2LMNAMEN1MAPT
SCHEMBL29874018 0.74 KMT2A (0.47) KMT2ASMN1; SMN2LMNAMEN1MAPT
SCHEMBL3132943 0.73 KMT2A (0.47) KMT2ARAB9ANPC1SMN1; SMN2LMNA

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-3822265-A1 SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS Bayer AG (DE) 2021-05-19 EP disclosed