SCHEMBL10856147

SCHEMBL10856147

NC(=O)OCC1=C(C(=O)O)N2C(=O)C(NC(=O)/C(=N\OC3CCCC3)c3nsc(N)n3)[C@H]2SC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 9/20 0.55
▸ NR1I2 O75469 5/20 0.55
▸ HSD17B10 Q99714 4/20 0.55
▸ PGR P06401 3/20 0.55
▸ ALDH1A1 P00352 2/20 0.55
▸ TSHR P16473 2/20 0.55
▸ MAPT P10636 5/20 0.53
▸ ALB P02768 1/20 0.53
▸ PPARG P37231 1/20 0.53
▸ SLC22A6 Q4U2R8 1/20 0.53
▸ SLC22A8 Q8TCC7 1/20 0.53
▸ SLC22A11 Q9NSA0 1/20 0.53
▸ HTR2C P28335 1/20 0.51
▸ POLB P06746 2/20 0.47
▸ PKM P14618 2/20 0.47
▸ CTDSP1 Q9GZU7 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ APEX1 P27695 3/20 0.45
▸ ABCC4 O15439 2/20 0.45
▸ LMNA P02545 2/20 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
SCHEMBL10856153 1.00 TDP1 (0.55) TDP1NR1I2HSD17B10PGRALDH1A1
SCHEMBL10782218 0.93 MAPT (0.61) TDP1NR1I2HSD17B10PGRALDH1A1
SCHEMBL10781239 0.92 NR1I2 (0.54) TDP1NR1I2HSD17B10PGRALDH1A1
SCHEMBL10838359 0.89 TDP1 (0.68) TDP1NR1I2HSD17B10PGRALDH1A1
SCHEMBL11365299 0.89 TDP1 (0.68) TDP1NR1I2HSD17B10PGRALDH1A1
SCHEMBL10838364 0.89 TDP1 (0.68) TDP1NR1I2HSD17B10PGRALDH1A1
SCHEMBL10850989 0.89 TDP1 (0.54) TDP1NR1I2HSD17B10PGRALDH1A1
SCHEMBL10850980 0.89 TDP1 (0.54) TDP1NR1I2HSD17B10PGRALDH1A1
SCHEMBL11036578 0.89 TDP1 (0.56) TDP1NR1I2HSD17B10PGRALDH1A1
SCHEMBL11084873 0.87 KCNH2 (0.45) TDP1NR1I2HSD17B10PGRALDH1A1

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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