SCHEMBL10939724

SCHEMBL10939724

Cc1nnc(SCC2=C(C(=O)O)N3C(=O)C(NC(=O)/C(=N\OCC(=O)O)c4cscn4)[C@H]3SC2)s1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTDSP1 Q9GZU7 2/20 0.62
▸ L3MBTL1 Q9Y468 3/20 0.60
▸ POLB P06746 6/20 0.59
▸ MAPT P10636 4/20 0.59
▸ ALDH1A1 P00352 2/20 0.59
▸ GAA P10253 1/20 0.59
▸ PTGS1 P23219 1/20 0.57
▸ PDE4A P27815 1/20 0.57
▸ KDR P35968 1/20 0.57
▸ TDP1 Q9NUW8 7/20 0.56
▸ LMNA P02545 3/20 0.56
▸ PTGS2 P35354 1/20 0.56
▸ SLC22A6 Q4U2R8 1/20 0.56
▸ SLC22A8 Q8TCC7 1/20 0.56
▸ SLC22A11 Q9NSA0 1/20 0.56
▸ MAPK1 P28482 1/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ PKM P14618 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ NR1I2 O75469 1/20 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
SCHEMBL10939732 1.00 CTDSP1 (0.62) CTDSP1L3MBTL1POLBMAPTALDH1A1
SCHEMBL10936551 0.92 CTDSP1 (0.58) CTDSP1L3MBTL1POLBMAPTALDH1A1
SCHEMBL10936568 0.92 CTDSP1 (0.58) CTDSP1L3MBTL1POLBMAPTALDH1A1
SCHEMBL10673948 0.88 TDP1 (0.56) CTDSP1L3MBTL1POLBMAPTALDH1A1
SCHEMBL10673946 0.88 TDP1 (0.56) CTDSP1L3MBTL1POLBMAPTALDH1A1
SCHEMBL10938948 0.87 NR1I2 (0.51) CTDSP1L3MBTL1POLBMAPTALDH1A1
SCHEMBL10938936 0.87 NR1I2 (0.51) CTDSP1L3MBTL1POLBMAPTALDH1A1
SCHEMBL11280701 0.86 CTDSP1 (0.59) CTDSP1L3MBTL1POLBMAPTALDH1A1
SCHEMBL10939435 0.86 NR1I2 (0.70) CTDSP1L3MBTL1POLBMAPTALDH1A1
SCHEMBL10939443 0.86 NR1I2 (0.70) CTDSP1L3MBTL1POLBMAPTALDH1A1

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-4499088-A BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-02-12 — — US disclosed
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