SCHEMBL9601580

SCHEMBL9601580

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTDSP1 Q9GZU7 2/20 0.56
▸ TDP1 Q9NUW8 7/20 0.53
▸ MAPT P10636 6/20 0.53
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ POLB P06746 7/20 0.52
▸ ALDH1A1 P00352 4/20 0.52
▸ GAA P10253 1/20 0.52
▸ LMNA P02545 2/20 0.52
▸ KMT2A Q03164 3/20 0.50
▸ HTT P42858 2/20 0.50
▸ NR1I2 O75469 1/20 0.50
▸ PGR P06401 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ MAPK1 P28482 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ PTGS2 P35354 1/20 0.49
▸ SLC22A6 Q4U2R8 1/20 0.49
▸ SLC22A8 Q8TCC7 1/20 0.49
▸ SLC22A11 Q9NSA0 1/20 0.49
▸ PTGS1 P23219 1/20 0.49

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
SCHEMBL9601592 1.00 CTDSP1 (0.56) CTDSP1TDP1MAPTL3MBTL1POLB
SCHEMBL9602756 0.91 NR1I2 (0.49) CTDSP1TDP1MAPTL3MBTL1POLB
SCHEMBL9602765 0.91 NR1I2 (0.49) CTDSP1TDP1MAPTL3MBTL1POLB
SCHEMBL9601903 0.91 NR1I2 (0.49) CTDSP1TDP1MAPTL3MBTL1POLB
SCHEMBL9601915 0.91 NR1I2 (0.49) CTDSP1TDP1MAPTL3MBTL1POLB
SCHEMBL9600724 0.89 NR1I2 (0.48) CTDSP1TDP1MAPTL3MBTL1POLB
SCHEMBL9600718 0.89 NR1I2 (0.48) CTDSP1TDP1MAPTL3MBTL1POLB
SCHEMBL9602244 0.88 NR1I2 (0.66) CTDSP1TDP1MAPTPOLBALDH1A1
SCHEMBL9602255 0.88 NR1I2 (0.66) CTDSP1TDP1MAPTPOLBALDH1A1
SCHEMBL11459698 0.88 CTDSP1 (0.61) CTDSP1TDP1MAPTL3MBTL1POLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0188254-B1 CEPHEM COMPOUNDS, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-03-24 — — EP disclosed
US-4761410-A MICROBIOCIDE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-08-02 — — US disclosed
EP-0188254-A2 Cephem compounds, processes for preparation thereof and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-07-23 — — EP disclosed
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