SCHEMBL10741606

SCHEMBL10741606

CC(N)ON=C(C(=O)NC1C(=O)N2CC(CSc3cnn[nH]3)(C(=O)O)CS[C@H]12)c1csc(N)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 6/20 0.42
▸ PGR P06401 4/20 0.42
▸ PTGS2 P35354 1/20 0.42
▸ HTR2C P28335 1/20 0.41
▸ TDP1 Q9NUW8 5/20 0.41
▸ APAF1 O14727 2/20 0.41
▸ APEX1 P27695 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ PLCG1 P19174 1/20 0.41
▸ ABCC2 Q92887 1/20 0.41
▸ SIRT5 Q9NXA8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ PPARG P37231 3/20 0.40
▸ SLC22A6 Q4U2R8 2/20 0.40
▸ SLC22A8 Q8TCC7 2/20 0.40
▸ SLC22A11 Q9NSA0 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ PSMD14 O00487 1/20 0.40
▸ MMP2 P08253 1/20 0.40

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
SCHEMBL11109200 0.96 NR1I2 (0.43) NR1I2PGRPTGS2HTR2CTDP1
SCHEMBL11105490 0.92 TDP1 (0.43) NR1I2PGRPTGS2HTR2CTDP1
SCHEMBL11102326 0.91 TDP1 (0.43) NR1I2PGRPTGS2HTR2CTDP1
SCHEMBL11104996 0.91 TDP1 (0.44) NR1I2PGRPTGS2HTR2CTDP1
SCHEMBL10744103 0.90 TDP1 (0.44) NR1I2PGRPTGS2HTR2CTDP1
SCHEMBL11111305 0.89 TDP1 (0.42) NR1I2PGRPTGS2HTR2CTDP1
SCHEMBL11108566 0.88 TDP1 (0.43) NR1I2PGRPTGS2HTR2CTDP1
SCHEMBL10983051 0.86 NR1I2 (0.39) NR1I2PGRPTGS2HTR2CTDP1
SCHEMBL11008334 0.84 NR1I2 (0.44) NR1I2PGRPTGS2HTR2CTDP1
SCHEMBL11110494 0.83 NR1I2 (0.56) NR1I2PGRPTGS2HTR2CTDP1

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-4698337-A Cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-10-06 — — US disclosed
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