SCHEMBL22559999

SCHEMBL22559999

O=C(Cc1ccccc1)NCI

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
HDAC8 Q9BY41 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61
HPGD P15428 3/20 0.59
GAA P10253 2/20 0.59
ALDH1A1 P00352 6/20 0.58
ATM Q13315 1/20 0.58
LMNA P02545 1/20 0.58
EPHX2 P34913 1/20 0.57
RAB9A P51151 1/20 0.56
CNR1 P21554 1/20 0.56
MAPT P10636 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
TRPV1 Q8NER1 1/20 0.56
KCNH2 Q12809 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
ERCC1 P07992 1/20 0.53
ERCC4 Q92889 1/20 0.53
POLB P06746 1/20 0.53

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
SCHEMBL11034177 0.83 HDAC8 (0.65) MEN1KMT2AHDAC8HDAC6HPGD
SCHEMBL26737017 0.82 KDM4E (0.44) MEN1KMT2AHDAC8HDAC6HPGD
SCHEMBL6289951 0.82 HPGD (0.68) MEN1KMT2AHDAC8HDAC6HPGD
SCHEMBL1454495 0.81 MEN1 (0.63) MEN1KMT2AHDAC8HDAC6HPGD
SCHEMBL392625 0.81 ALDH1A1 (0.82) MEN1KMT2AHDAC8HDAC6HPGD
SCHEMBL10598870 0.80 ERCC1 (0.73) MEN1KMT2AHDAC8HDAC6HPGD
SCHEMBL21398985 0.80 KMT2A (0.57) MEN1KMT2AHDAC8HDAC6HPGD
Iodomethane SCHEMBL8660642 0.80 MEN1 (0.57) MEN1KMT2AHDAC8HDAC6HPGD
SCHEMBL1095091 0.79 MEN1 (0.61) MEN1KMT2AHDAC8HDAC6HPGD
Phenaceturic Acid SCHEMBL14126285 0.79 ATM (0.62) MEN1KMT2AHDAC8HDAC6HPGD

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
US-10808059-B2 Polymer CANON KABUSHIKI KAISHA (JP) 2020-10-20 US disclosed