SCHEMBL2660728

SCHEMBL2660728

COS(=O)(=O)CC1CN=C(c2cc3cccc(NS(=O)(=O)c4ncccc4C)c3[nH]2)S1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37
TUBA4A P68366 1/20 0.37
TUBB4B P68371 1/20 0.37
TUBB3 Q13509 1/20 0.37
TUBB2A Q13885 1/20 0.37
TUBB8 Q3ZCM7 1/20 0.37
TUBA3E Q6PEY2 1/20 0.37
TUBA1A Q71U36 1/20 0.37
TUBA1C Q9BQE3 1/20 0.37
TUBB6 Q9BUF5 1/20 0.37
TUBB2B Q9BVA1 1/20 0.37
TUBB1 Q9H4B7 1/20 0.37
SLC40A1 Q9NP59 10/20 0.36
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
TDP1 Q9NUW8 3/20 0.33
NFKBIA P25963 2/20 0.33

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
SCHEMBL2660730 0.75 OXTR (0.31)
SCHEMBL9073038 0.73 SLC40A1 (0.38) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL2659602 0.73
SCHEMBL2660220 0.72 MMP2 (0.43) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL2661096 0.72 ELANE (0.32) CXCR2CXCR4
SCHEMBL2661075 0.72 GLO1 (0.41) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL2659940 0.71 TUBB4A (0.36) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL2966007 0.70 GLO1 (0.41) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL2668643 0.70 SLC40A1 (0.42) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL2668718 0.70 BRD4 (0.44) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2074119-A1 INDOLE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2009-07-01 EP disclosed
WO-2008050821-A1 INDOLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-05-02 WO disclosed