SCHEMBL9233147

SCHEMBL9233147

COc1ccc(COC(=O)C2=C(CI)CS[C@@H]3[C@H](NC(=O)/C(=N/OC(c4ccccc4)(c4ccccc4)c4ccccc4)c4csc(NC(c5ccccc5)(c5ccccc5)c5ccccc5)n4)C(=O)N23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 6/20 0.46
▸ MAPT P10636 3/20 0.46
▸ PPARG P37231 2/20 0.46
▸ ALB P02768 1/20 0.46
▸ SLC22A6 Q4U2R8 1/20 0.46
▸ SLC22A8 Q8TCC7 1/20 0.46
▸ SLC22A11 Q9NSA0 1/20 0.46
▸ HTR2C P28335 1/20 0.46
▸ KMT2A Q03164 1/20 0.44
▸ PGR P06401 3/20 0.44
▸ ESR1 P03372 2/20 0.44
▸ TDP1 Q9NUW8 6/20 0.43
▸ HSD17B10 Q99714 4/20 0.43
▸ APEX1 P27695 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ ABCC4 O15439 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ POLB P06746 1/20 0.43

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
SCHEMBL9233155 1.00 NR1I2 (0.46) NR1I2MAPTPPARGALBSLC22A6
SCHEMBL8988481 1.00 NR1I2 (0.46) NR1I2MAPTPPARGALBSLC22A6
SCHEMBL9016689 0.95 NR1I2 (0.46) NR1I2MAPTPPARGALBSLC22A6
SCHEMBL7763221 0.95 NR1I2 (0.46) NR1I2MAPTPPARGALBSLC22A6
SCHEMBL8988678 0.95 NR1I2 (0.46) NR1I2MAPTPPARGALBSLC22A6
SCHEMBL8756548 0.95 NR1I2 (0.46) NR1I2MAPTPPARGALBSLC22A6
SCHEMBL7763218 0.95 NR1I2 (0.46) NR1I2MAPTPPARGALBSLC22A6
SCHEMBL8439987 0.95 NR1I2 (0.46) NR1I2MAPTPPARGALBSLC22A6
SCHEMBL8988441 0.95 NR1I2 (0.52) NR1I2MAPTPPARGALBSLC22A6
SCHEMBL8756668 0.90 NR1I2 (0.52) NR1I2MAPTPPARGALBSLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0641797-A1 Cephem derivatives and antimicrobial agents containing the same KATAYAMA SEIYAKUSYO CO. Ltd. (JP) 1995-03-08 — — EP disclosed
EP-0554004-A2 Cephem compounds and antibacterial agents KATAYAMA SEIYAKUSYO CO. Ltd. (JP) 1993-08-04 — — EP disclosed
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