SCHEMBL11459698

SCHEMBL11459698

Cc1nnc(SCC2=C(C(=O)O)N3C(=O)C(NC(=O)C(=O)c4csc(NC(c5ccccc5)(c5ccccc5)c5ccccc5)n4)[C@@H]3SC2)s1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTDSP1 Q9GZU7 2/20 0.61
▸ POLB P06746 8/20 0.58
▸ MAPT P10636 8/20 0.58
▸ ALDH1A1 P00352 4/20 0.58
▸ GAA P10253 1/20 0.58
▸ TDP1 Q9NUW8 8/20 0.58
▸ L3MBTL1 Q9Y468 2/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ LMNA P02545 3/20 0.55
▸ PTGS2 P35354 1/20 0.55
▸ SLC22A6 Q4U2R8 1/20 0.55
▸ SLC22A8 Q8TCC7 1/20 0.55
▸ SLC22A11 Q9NSA0 1/20 0.55
▸ PTGS1 P23219 1/20 0.55
▸ PDE4A P27815 1/20 0.55
▸ KDR P35968 1/20 0.55
▸ KMT2A Q03164 3/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ PKM P14618 1/20 0.53
▸ HTT P42858 2/20 0.53

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
SCHEMBL11574347 0.90 CTDSP1 (0.51) CTDSP1POLBMAPTALDH1A1GAA
SCHEMBL9601592 0.88 CTDSP1 (0.56) CTDSP1POLBMAPTALDH1A1GAA
SCHEMBL9601580 0.88 CTDSP1 (0.56) CTDSP1POLBMAPTALDH1A1GAA
SCHEMBL11010118 0.87 POLB (0.62) CTDSP1POLBMAPTALDH1A1GAA
SCHEMBL6703100 0.86 CA5A (0.48) CTDSP1POLBMAPTTDP1L3MBTL1
SCHEMBL11004390 0.85 POLB (0.65) CTDSP1POLBMAPTALDH1A1GAA
Hydrochloric Acid SCHEMBL11009162 0.84 POLB (0.65) CTDSP1POLBMAPTALDH1A1GAA
SCHEMBL11006896 0.83 LMNA (0.57) CTDSP1POLBMAPTALDH1A1GAA
SCHEMBL11459705 0.83 TDP1 (0.59) CTDSP1POLBMAPTALDH1A1TDP1
SCHEMBL9643776 0.81 CTDSP1 (0.47) CTDSP1POLBMAPTALDH1A1GAA

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-4201779-A 7[(2-Amino-thiazol-4-yl)glyoxylamido]-cephem derivatives and processes for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1980-05-06 — — US disclosed
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