SCHEMBL10762469

SCHEMBL10762469

CC(=O)OCC1=C(C(=O)OC(c2ccccc2)c2ccccc2)N2C(=O)C(NC(=O)/C(=N\OCc3csc(NC(c4ccccc4)(c4ccccc4)c4ccccc4)n3)c3csc(NC(c4ccccc4)(c4ccccc4)c4ccccc4)n3)[C@@H]2SC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.53
▸ NR1I2 O75469 4/20 0.53
▸ PPARG P37231 2/20 0.53
▸ SLC22A6 Q4U2R8 2/20 0.53
▸ SLC22A8 Q8TCC7 2/20 0.53
▸ SLC22A11 Q9NSA0 2/20 0.53
▸ ALB P02768 1/20 0.53
▸ TDP1 Q9NUW8 8/20 0.50
▸ APEX1 P27695 3/20 0.50
▸ L3MBTL1 Q9Y468 3/20 0.50
▸ ABCC4 O15439 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ LMNA P02545 2/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ PKM P14618 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ POLB P06746 1/20 0.50
▸ RECQL P46063 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ PTGS1 P23219 2/20 0.47

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
SCHEMBL10430345 0.92 MAPT (0.53) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9813268 0.91 CTDSP1 (0.56) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL10834932 0.91 PTGS1 (0.47) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL10834938 0.91 PTGS1 (0.47) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL10834350 0.89 NR1I2 (0.42) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL10834352 0.89 NR1I2 (0.42) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9361941 0.88 PTGS1 (0.45) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9734755 0.88 PTGS1 (0.45) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9734762 0.88 PTGS1 (0.45) MAPTNR1I2PPARGSLC22A6SLC22A8
SCHEMBL9361950 0.88 PTGS1 (0.45) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4690921-A BACTERICIDES YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1987-09-01 — — US disclosed
US-4608373-A BACTERICIDES, ANTIBIOTICS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1986-08-26 — — US disclosed
EP-0142274-A2 Cephalosporin compounds and salts thereof, their production, and medicaments containing them YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1985-05-22 — — EP disclosed
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