SCHEMBL9372145

SCHEMBL9372145

CC(Cc1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1)(O/N=C\C(=O)N[C@@H]1C(=O)N2C(C(=O)O)=C(CCl)CS[C@H]12)C(=O)OC(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ NR1I2 O75469 5/20 0.37
▸ SLC22A6 Q4U2R8 3/20 0.37
▸ SLC22A8 Q8TCC7 3/20 0.37
▸ SLC22A11 Q9NSA0 3/20 0.37
▸ PPARG P37231 2/20 0.37
▸ PGR P06401 1/20 0.37
▸ ALDH1A1 P00352 6/20 0.36
▸ MAPT P10636 6/20 0.36
▸ HSD17B10 Q99714 5/20 0.36
▸ TDP1 Q9NUW8 5/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ HPGD P15428 4/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ CYP3A4 P08684 3/20 0.36
▸ CTDSP1 Q9GZU7 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ SLC15A2 Q16348 2/20 0.36
▸ CYP2C9 P11712 2/20 0.36

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
SCHEMBL9367257 0.93 CTDSP1 (0.38) PTGS1L3MBTL1NR1I2SLC22A6SLC22A8
SCHEMBL9622955 0.77 NR1I2 (0.49) PTGS1L3MBTL1NR1I2SLC22A6SLC22A8
SCHEMBL9361968 0.77 NR1I2 (0.49) PTGS1L3MBTL1NR1I2SLC22A6SLC22A8
SCHEMBL10563345 0.77 NR1I2 (0.49) PTGS1L3MBTL1NR1I2SLC22A6SLC22A8
SCHEMBL9361977 0.77 NR1I2 (0.49) PTGS1L3MBTL1NR1I2SLC22A6SLC22A8
SCHEMBL9201934 0.77 NR1I2 (0.47) PTGS1L3MBTL1NR1I2SLC22A6SLC22A8
SCHEMBL5712656 0.77 NR1I2 (0.47) PTGS1L3MBTL1NR1I2SLC22A6SLC22A8
SCHEMBL5712657 0.77 NR1I2 (0.47) PTGS1L3MBTL1NR1I2SLC22A6SLC22A8
SCHEMBL8371361 0.77 TDP1 (0.44) PTGS1L3MBTL1NR1I2SLC22A6SLC22A8
SCHEMBL9369561 0.77 TDP1 (0.37) PTGS1L3MBTL1NR1I2SLC22A6SLC22A8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0349340-B1 Novel cephem compound, method for producing the same and anti-bacterial agent MEIJI SEIKA CO (JP) 1994-09-07 — — EP disclosed
US-4988686-A Cephalosporin antibiotics MEIJI SEIKA KABUSHIKI KAISHA (JP) 1991-01-29 — — US disclosed
EP-0349340-A2 Novel cephem compound, method for producing the same and anti-bacterial agent MEIJI SEIKA KABUSHIKI KAISHA (JP) 1990-01-03 — — EP disclosed
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