SCHEMBL6939482

SCHEMBL6939482

CCCSc1ccccc1C(=O)NN

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
PTGS2 P35354 1/20 0.50
CTSD P07339 1/20 0.47
ALDH1A1 P00352 6/20 0.47
HSD17B10 Q99714 5/20 0.47
ALOX15 P16050 2/20 0.47
POLB P06746 2/20 0.47
PKM P14618 1/20 0.47
HPGD P15428 6/20 0.47
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
TDP1 Q9NUW8 2/20 0.44
ALOX12 P18054 1/20 0.44

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
SCHEMBL6564706 0.90 PTGS2 (0.54) KMT2AL3MBTL1PTGS2CTSDALDH1A1
SCHEMBL6564711 0.88 PTGS2 (0.55) KMT2AL3MBTL1PTGS2ALDH1A1HSD17B10
SCHEMBL6942406 0.86 HPGD (0.57) KMT2AL3MBTL1CTSDALDH1A1HSD17B10
SCHEMBL6780943 0.83 PTGS2 (0.53) KMT2AL3MBTL1PTGS2ALDH1A1HSD17B10
SCHEMBL6779779 0.81 CYP1A2 (0.62) KMT2AL3MBTL1PTGS2ALDH1A1HSD17B10
SCHEMBL26942233 0.81 PTGS2 (0.58) KMT2AL3MBTL1PTGS2ALDH1A1HSD17B10
SCHEMBL6934863 0.80 LMNA (0.46) KMT2AL3MBTL1CTSDALDH1A1HSD17B10
SCHEMBL8626312 0.80 KMT2A (0.69) KMT2AL3MBTL1ALDH1A1HSD17B10ALOX15
SCHEMBL10144072 0.80 HSD17B10 (0.67) KMT2AL3MBTL1PTGS2ALDH1A1HSD17B10
SCHEMBL6939026 0.79 KMT2A (0.63) KMT2AL3MBTL1ALDH1A1HSD17B10HPGD

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-1272456-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2003-01-08 EP claimed
WO-2001079157-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2001-10-25 WO claimed