SCHEMBL8567489

SCHEMBL8567489

Cc1cc(-c2ccccn2)sc1C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 3/20 0.51
KDM4E B2RXH2 5/20 0.48
NPC1 O15118 2/20 0.47
GLA P06280 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
ALOX5 P09917 1/20 0.47
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 1/20 0.46
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46

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
SCHEMBL2170554 0.87 KDM4E (0.57) IKBKBKDM4ENPC1GLAMAPT
Hydrochloric Acid SCHEMBL27839230 0.85 KDM4E (0.56) IKBKBKDM4ENPC1GLAMAPT
SCHEMBL13906511 0.83 KDM4E (0.49) KDM4ENPC1GLAMAPTRAB9A
SCHEMBL5032068 0.79 CHEK2 (0.50) IKBKBKDM4ENPC1GLAMAPT
SCHEMBL12495674 0.76 IKBKB (0.68) IKBKBKDM4ENPC1MAPTRAB9A
SCHEMBL20750383 0.76 KDM4E (0.59) KDM4ENPC1GLAMAPTRAB9A
SCHEMBL4095895 0.76 IKBKB (0.62) IKBKBKDM4ENPC1GLAMAPT
SCHEMBL29504574 0.75 IKBKB (0.53) IKBKBKDM4EALOX5ALDH1A1KMT2A
SCHEMBL7063637 0.73 KDM4E (0.76) IKBKBKDM4ENPC1MAPTRAB9A
SCHEMBL8570029 0.73 KDM4E (0.40) KDM4ENPC1RAB9AALDH1A1KMT2A

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-5846990-A Substituted biphenyl isoxazole sulfonamides BRISTOL-MYERS SQUIBB CO. (US) 1998-12-08 US disclosed