SCHEMBL9360854

SCHEMBL9360854

CCON=C(C(=O)N[C@@H]1C(=O)N2C(OC(=O)O)=C(CSc3ncc(-c4ccc(OC(C)=O)c(OC(C)=O)c4)o3)CS[C@@H]12)c1csc(N)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.47
▸ NR1I2 O75469 4/20 0.47
▸ PPARG P37231 2/20 0.47
▸ SLC22A6 Q4U2R8 2/20 0.47
▸ SLC22A8 Q8TCC7 2/20 0.47
▸ SLC22A11 Q9NSA0 2/20 0.47
▸ ALB P02768 1/20 0.47
▸ PGR P06401 2/20 0.46
▸ HTR2C P28335 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ DAO P14920 1/20 0.45
▸ SNCA P37840 1/20 0.45
▸ CYP2J2 P51589 1/20 0.45
▸ TDP1 Q9NUW8 8/20 0.45
▸ APEX1 P27695 4/20 0.45
▸ HSD17B10 Q99714 3/20 0.45
▸ ABCC4 O15439 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ POLB P06746 2/20 0.45
▸ RECQL P46063 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
SCHEMBL9361603 0.93 MAPT (0.55) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9360846 0.93 MAPT (0.55) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9360447 0.92 NR1I2 (0.47) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9361123 0.91 TDP1 (0.56) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9361137 0.91 TDP1 (0.56) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9361126 0.91 NR1I2 (0.47) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9361082 0.89 MAPT (0.49) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9361963 0.87 NR1I2 (0.48) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9361709 0.86 NR1I2 (0.54) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9360400 0.85 NR1I2 (0.54) MAPTNR1I2PPARGSLC22A6SLC22A8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0241901-B1 Cephalosporin derivatives, processes for their preparation and antibacterial agents BANYU PHARMA CO LTD (JP) 1994-08-24 — — EP claimed
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