SCHEMBL23959500

SCHEMBL23959500

NC/C=C/CNC(=O)Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.58
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
GAA P10253 2/20 0.51
HPGD P15428 2/20 0.51
ALDH1A1 P00352 5/20 0.50
ATM Q13315 1/20 0.50
LMNA P02545 1/20 0.50
CA12 O43570 2/20 0.49
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
CA5A P35218 2/20 0.49
CA7 P43166 2/20 0.49
CA9 Q16790 2/20 0.49
CA5B Q9Y2D0 2/20 0.49
CA14 Q9ULX7 1/20 0.49
RAB9A P51151 2/20 0.49
MAPT P10636 2/20 0.49

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
SCHEMBL868147 0.80 EPHX2 (0.58) EPHX2MEN1KMT2AHDAC8HDAC6
SCHEMBL6631803 0.79 KCNH2 (0.58) EPHX2MEN1KMT2AHDAC8HDAC6
SCHEMBL4528693 0.77 HPGD (0.66) EPHX2MEN1KMT2AHDAC8HDAC6
SCHEMBL21620361 0.76 LMNA (0.56) LMNACA12CA1CA2CA9
SCHEMBL10463546 0.75 SMN1; SMN2 (0.57) EPHX2MEN1KMT2AHDAC8HDAC6
SCHEMBL23959499 0.75 EPHX2 (0.49) EPHX2MEN1KMT2AGAAHPGD
SCHEMBL11034177 0.75 HDAC8 (0.65) EPHX2MEN1KMT2AHDAC8HDAC6
Ammonia Solution, Strong SCHEMBL9177723 0.75 HPGD (0.64) EPHX2MEN1KMT2AHDAC8HDAC6
Hydrochloric Acid SCHEMBL5023736 0.75 HPGD (0.64) EPHX2MEN1KMT2AHDAC8HDAC6
SCHEMBL23933801 0.74 MMP2 (0.43)

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-2021217041-A1 N-SUBSTITUTED ALPHA-AMINO AND ALPHA-HYDROXY CARBOXAMIDE DERIVATIVES IMMVENTION THERAPEUTIX (US) 2021-10-28 WO disclosed