SCHEMBL11176964

SCHEMBL11176964

CSCc1nnc(SCC2=C(C(=O)O)N3C(=O)C(NC(=O)Cc4csc(N)n4)[C@@H]3SC2)s1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 7/20 0.65
▸ LMNA P02545 3/20 0.65
▸ HSD17B10 Q99714 1/20 0.65
▸ L3MBTL1 Q9Y468 3/20 0.64
▸ CTDSP1 Q9GZU7 2/20 0.55
▸ POLB P06746 7/20 0.55
▸ ALDH1A1 P00352 3/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ MAPT P10636 5/20 0.54
▸ PTGS2 P35354 1/20 0.54
▸ SLC22A6 Q4U2R8 1/20 0.54
▸ SLC22A8 Q8TCC7 1/20 0.54
▸ SLC22A11 Q9NSA0 1/20 0.54
▸ PTGS1 P23219 1/20 0.54
▸ PDE4A P27815 1/20 0.54
▸ KDR P35968 1/20 0.54
▸ GAA P10253 1/20 0.54
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ PKM P14618 1/20 0.52

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
SCHEMBL11176958 1.00 TDP1 (0.65) TDP1LMNAHSD17B10L3MBTL1CTDSP1
SCHEMBL11188369 0.92 TDP1 (0.64) TDP1LMNAHSD17B10L3MBTL1CTDSP1
SCHEMBL11188372 0.92 TDP1 (0.64) TDP1LMNAHSD17B10L3MBTL1CTDSP1
SCHEMBL11194560 0.92 TDP1 (0.66) TDP1LMNAHSD17B10L3MBTL1CTDSP1
SCHEMBL11183181 0.91 TDP1 (0.68) TDP1LMNAHSD17B10L3MBTL1CTDSP1
SCHEMBL11183173 0.91 TDP1 (0.68) TDP1LMNAHSD17B10L3MBTL1CTDSP1
SCHEMBL11374304 0.91 TDP1 (0.62) TDP1LMNAHSD17B10L3MBTL1CTDSP1
SCHEMBL11181090 0.90 TDP1 (0.67) TDP1LMNAHSD17B10L3MBTL1CTDSP1
SCHEMBL11181096 0.90 TDP1 (0.67) TDP1LMNAHSD17B10L3MBTL1CTDSP1
SCHEMBL8867974 0.90 TDP1 (0.68) TDP1LMNAHSD17B10L3MBTL1CTDSP1

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-4379924-A Cephalosporin derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1983-04-12 — — US claimed
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