SCHEMBL6289951

SCHEMBL6289951

[O]CCNC(=O)Cc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.68
GAA P10253 2/20 0.68
ATM Q13315 1/20 0.66
TRPV1 Q8NER1 2/20 0.64
CNR1 P21554 1/20 0.64
ALDH1A1 P00352 6/20 0.62
KCNH2 Q12809 1/20 0.62
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
HDAC8 Q9BY41 1/20 0.59
HDAC6 Q9UBN7 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.57
LMNA P02545 1/20 0.56
EPHX2 P34913 1/20 0.55
RAB9A P51151 1/20 0.54
MAPT P10636 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA5A P35218 1/20 0.54

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
SCHEMBL10585628 0.86 TRPV1 (0.83) HPGDGAAATMTRPV1CNR1
SCHEMBL320807 0.84 HPGD (0.68) HPGDGAAATMTRPV1CNR1
SCHEMBL4153733 0.84 HPGD (0.79) HPGDGAAATMTRPV1CNR1
SCHEMBL5878927 0.84 HPGD (0.68) HPGDGAAATMTRPV1CNR1
SCHEMBL3688416 0.82 HPGD (0.66) HPGDGAAATMTRPV1CNR1
SCHEMBL5181766 0.82 HPGD (0.66) HPGDGAAATMTRPV1CNR1
SCHEMBL4528693 0.82 HPGD (0.66) HPGDGAAATMTRPV1CNR1
SCHEMBL1927410 0.82 HPGD (0.66) HPGDGAAATMTRPV1CNR1
SCHEMBL2967921 0.82 HPGD (0.66) HPGDGAAATMTRPV1CNR1
SCHEMBL11114018 0.82 HPGD (0.66) HPGDGAAATMTRPV1CNR1

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-6867200-B1 (Hetero)aryl-bicyclic heteroaryl derivatives, their preparation and their use as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-03-15 US disclosed