SCHEMBL7008499

SCHEMBL7008499

O=C(O)N1CCN(C2CS(=O)(=O)C2)CC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
POLB P06746 3/20 0.33
HSD17B10 Q99714 1/20 0.33
KDM4E B2RXH2 5/20 0.33
ALDH1A1 P00352 4/20 0.33
HPGD P15428 1/20 0.32
HRH3 Q9Y5N1 5/20 0.32
L3MBTL3 Q96JM7 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
KCNH2 Q12809 1/20 0.32

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
SCHEMBL7008496 0.83 POLB (0.33) POLBHSD17B10KDM4EALDH1A1HRH3
SCHEMBL3589415 0.80 POLB (0.42) SMN1; SMN2POLBHSD17B10KDM4EALDH1A1
SCHEMBL65329 0.78 HRH3 (0.47) POLBHSD17B10KDM4EALDH1A1HRH3
SCHEMBL4324356 0.75 L3MBTL3 (0.38) POLBHSD17B10KDM4EALDH1A1HRH3
SCHEMBL65252 0.74 POLB (0.52) POLBHSD17B10KDM4EALDH1A1HRH3
SCHEMBL2553841 0.74 HRH3 (0.44) POLBHSD17B10KDM4EALDH1A1HRH3
SCHEMBL3768409 0.74 POLB (0.56) SMN1; SMN2POLBHSD17B10KDM4EALDH1A1
SCHEMBL1464487 0.73 L3MBTL3 (0.55) POLBHSD17B10KDM4EALDH1A1HRH3
SCHEMBL5889057 0.73 USP2 (0.47) SMN1; SMN2POLBKDM4EALDH1A1HPGD
SCHEMBL21140974 0.73 SMN1; SMN2 (0.41) SMN1; SMN2POLBKDM4EALDH1A1HPGD

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-1341540-A2 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2003-09-10 EP disclosed
WO-2002045652-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2002-06-13 WO disclosed