SCHEMBL10859751

SCHEMBL10859751

CC1=C(C(=O)O)N2C(=O)C(NC(=O)C(=NOC3C=CCC3)c3nsc(N)n3)[C@@H]2SC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.45
▸ NR1I2 O75469 3/20 0.45
▸ HTR2C P28335 1/20 0.45
▸ MAPK1 P28482 2/20 0.44
▸ MAPT P10636 4/20 0.43
▸ ALB P02768 1/20 0.43
▸ PPARG P37231 1/20 0.43
▸ SLC22A6 Q4U2R8 1/20 0.43
▸ SLC22A8 Q8TCC7 1/20 0.43
▸ SLC22A11 Q9NSA0 1/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ TDP1 Q9NUW8 4/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ CYP2C19 P33261 3/20 0.42
▸ HSD17B10 Q99714 3/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ BLM P54132 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ ADRA1A P35348 1/20 0.42

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
SCHEMBL10859746 1.00 KCNH2 (0.45) KCNH2NR1I2HTR2CMAPK1MAPT
SCHEMBL10850907 0.96 KCNH2 (0.44) KCNH2NR1I2HTR2CMAPK1MAPT
SCHEMBL10850910 0.96 KCNH2 (0.44) KCNH2NR1I2HTR2CMAPK1MAPT
SCHEMBL10859989 0.88 NR1I2 (0.46) KCNH2NR1I2HTR2CMAPK1MAPT
SCHEMBL10859980 0.88 NR1I2 (0.46) KCNH2NR1I2HTR2CMAPK1MAPT
SCHEMBL10782248 0.88 MAPT (0.60) NR1I2HTR2CMAPK1MAPTALB
SCHEMBL11452210 0.88 MAPT (0.60) NR1I2HTR2CMAPK1MAPTALB
SCHEMBL10850980 0.87 TDP1 (0.54) KCNH2NR1I2HTR2CMAPK1MAPT
SCHEMBL10850989 0.87 TDP1 (0.54) KCNH2NR1I2HTR2CMAPK1MAPT
SCHEMBL11041666 0.87 NR1I2 (0.52) KCNH2NR1I2HTR2CMAPTALB

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 7 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-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
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