SCHEMBL10854679

SCHEMBL10854679

Nc1nc(C(=NOCc2ccccc2)C(=O)NC2C(=O)N3C(C(=O)O)=C(CSc4nncs4)CS[C@@H]23)ns1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.50
▸ NR1I2 O75469 5/20 0.49
▸ PGR P06401 3/20 0.49
▸ KCNH2 Q12809 1/20 0.49
▸ HTR2C P28335 1/20 0.48
▸ PPARG P37231 2/20 0.47
▸ SLC22A6 Q4U2R8 2/20 0.47
▸ SLC22A8 Q8TCC7 2/20 0.47
▸ SLC22A11 Q9NSA0 2/20 0.47
▸ DAO P14920 1/20 0.47
▸ SNCA P37840 1/20 0.47
▸ CYP2J2 P51589 1/20 0.47
▸ ABCC4 O15439 1/20 0.47
▸ ALB P02768 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ CTDSP1 Q9GZU7 1/20 0.46
▸ TDP1 Q9NUW8 4/20 0.45
▸ TSHR P16473 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45

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
SCHEMBL10854673 1.00 KMT2A (0.50) KMT2ANR1I2PGRKCNH2HTR2C
SCHEMBL10851315 0.92 TDP1 (0.52) KMT2ANR1I2PGRKCNH2HTR2C
SCHEMBL10851319 0.92 TDP1 (0.52) KMT2ANR1I2PGRKCNH2HTR2C
SCHEMBL10857781 0.92 NR1I2 (0.50) KMT2ANR1I2PGRKCNH2HTR2C
SCHEMBL10857784 0.92 NR1I2 (0.50) KMT2ANR1I2PGRKCNH2HTR2C
SCHEMBL10838302 0.91 KCNH2 (0.57) KMT2ANR1I2PGRKCNH2HTR2C
SCHEMBL10838309 0.91 KCNH2 (0.57) KMT2ANR1I2PGRKCNH2HTR2C
SCHEMBL10858360 0.91 CTDSP1 (0.50) KMT2ANR1I2PGRKCNH2HTR2C
SCHEMBL10858356 0.91 CTDSP1 (0.50) KMT2ANR1I2PGRKCNH2HTR2C
SCHEMBL10849116 0.90 NR1I2 (0.52) KMT2ANR1I2PGRKCNH2HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4567275-A 2-(5-AMINO-1,2,4-THIADIAZOL-3-YL)GLYOXYLIC ACID FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-01-28 — — US disclosed
US-4468515-A CEPRALOSPORINS, MICROBIOCIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-08-28 — — US disclosed
US-4425340-A ANTIBIOTICS, BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-01-10 — — US disclosed
US-4390534-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-06-28 — — US disclosed
US-4381299-A 7-Amino-thiadiazole oxyimino derivatives of cephem and cepham compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-04-26 — — US disclosed
EP-0064582-A1 Starting compounds for preparing cephem compounds and processes for their preparation FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-11-17 — — EP disclosed
US-4332798-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-06-01 — — US disclosed
US-4331665-A ANTIBIOTICS, BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-05-25 — — US disclosed
EP-0013762-A2 Cephem and cepham compounds, processes for their preparation, pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-08-06 — — EP disclosed
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