SCHEMBL10647916

SCHEMBL10647916

CCSC1=C(C(=O)OC(c2ccccc2)c2ccccc2)N2C(=O)C(NC(=O)C(=NOCC(=O)OC(C)(C)C)c3nc(NC=O)sc3Cl)[C@@H]2SC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTDSP1 Q9GZU7 2/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ TDP1 Q9NUW8 7/20 0.35
▸ ALDH1A1 P00352 7/20 0.35
▸ HSD17B10 Q99714 7/20 0.35
▸ KDM4E B2RXH2 5/20 0.35
▸ MAPT P10636 5/20 0.35
▸ HPGD P15428 4/20 0.35
▸ CYP3A4 P08684 4/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ CYP2C9 P11712 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ NR1I2 O75469 2/20 0.35
▸ SLC15A2 Q16348 2/20 0.35
▸ ADORA3 P0DMS8 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ APAF1 O14727 2/20 0.34
▸ TSHR P16473 1/20 0.34
▸ APEX1 P27695 1/20 0.34

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
SCHEMBL10647912 1.00 CTDSP1 (0.35) CTDSP1KCNH2TDP1ALDH1A1HSD17B10
SCHEMBL10643136 0.91 KCNH2 (0.40) CTDSP1KCNH2TDP1ALDH1A1HSD17B10
SCHEMBL10643131 0.91 KCNH2 (0.40) CTDSP1KCNH2TDP1ALDH1A1HSD17B10
SCHEMBL9481609 0.90 TDP1 (0.44) CTDSP1TDP1ALDH1A1HSD17B10KDM4E
SCHEMBL9481600 0.90 TDP1 (0.44) CTDSP1TDP1ALDH1A1HSD17B10KDM4E
SCHEMBL10645127 0.89 TDP1 (0.40) CTDSP1KCNH2TDP1ALDH1A1HSD17B10
SCHEMBL10645132 0.89 TDP1 (0.40) CTDSP1KCNH2TDP1ALDH1A1HSD17B10
SCHEMBL10644255 0.89 TDP1 (0.42) KCNH2TDP1ALDH1A1HSD17B10MAPT
SCHEMBL10644260 0.89 TDP1 (0.42) KCNH2TDP1ALDH1A1HSD17B10MAPT
SCHEMBL10643411 0.87 TDP1 (0.38) CTDSP1KCNH2TDP1ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0057422-B1 NEW CEPHEM COMPOUNDS, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-10-12 — — EP disclosed
EP-0191507-A2 New 2-oxyimino-3-oxobutyric acid derivatives and process for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-08-20 — — EP disclosed
US-4452851-A BACTERICIDES, ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-06-05 — — US disclosed
EP-0057422-A2 New cephem compounds, processes for preparation thereof and pharmaceutical composition containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-08-11 — — EP disclosed
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