SCHEMBL6508907

SCHEMBL6508907

Cc1ccc(C(=O)Nc2cc(C(N)=O)c(NC(N)=O)s2)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 5/20 0.50
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
JAK2 O60674 2/20 0.50
EIF2AK2 P19525 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
JAK3 P52333 1/20 0.49
NPC1 O15118 5/20 0.48
RAB9A P51151 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
MAPT P10636 3/20 0.48
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
CASP3 P42574 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
CHEK1 O14757 6/20 0.47
CFTR P13569 2/20 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
SCHEMBL6510323 0.76 HDAC1 (0.52) IKBKBKMT2AMEN1JAK2EIF2AK2
SCHEMBL6509110 0.76 IKBKB (0.63) IKBKBKMT2AMEN1JAK2EIF2AK2
SCHEMBL6511724 0.75 MAPT (0.51) IKBKBKMT2AMEN1JAK2EIF2AK2
SCHEMBL11921318 0.75 IKBKB (0.59) IKBKBKMT2AMEN1JAK2EIF2AK2
SCHEMBL6504891 0.75 IKBKB (0.57) IKBKBKMT2AMEN1JAK2EIF2AK2
SCHEMBL6530279 0.75 IKBKB (0.48) IKBKBKMT2AMEN1JAK2EIF2AK2
SCHEMBL6509621 0.74 SMN1; SMN2 (0.65) IKBKBKMT2AMEN1NPC1RAB9A
SCHEMBL6503091 0.74 IKBKB (0.50) IKBKBKMT2AMEN1JAK2EIF2AK2
SCHEMBL16246484 0.74 NPC1 (0.57) KMT2AMEN1NPC1RAB9ASMN1; SMN2
SCHEMBL6512284 0.74 CHEK1 (0.47) IKBKBKMT2AMEN1JAK2EIF2AK2

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-2005105777-A1 SUBSTITUTED THIOPHENE AMIDE COMPOUNDS FOR THE TREATMENT OF INFLAMMATION PHARMACIA & UPJOHN COMPANY LLC (US) 2005-11-10 WO disclosed