SCHEMBL9142124

SCHEMBL9142124

O=[C]C(NC(=O)c1cnccc1O)c1ccc(O)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ HPGD P15428 2/20 0.33
▸ ROCK2 O75116 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ CYP17A1 P05093 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP19A1 P11511 1/20 0.33
▸ CYP11B1 P15538 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33
▸ LMNA P02545 2/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ ROCK1 Q13464 1/20 0.32
▸ HSD17B2 P37059 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ RPS6KA3 P51812 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ KCNMA1 Q12791 1/20 0.30

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
SCHEMBL8621358 0.78 TACR3 (0.34) ALDH1A1KDM4EHPGDLMNAHSD17B10
SCHEMBL8075796 0.75 GFER (0.46) ALDH1A1KDM4EKMT2AHPGDMEN1
SCHEMBL11750861 0.72 EGLN1 (0.35) ALDH1A1KMT2AMEN1LMNASMN1; SMN2
SCHEMBL10544974 0.70 LMNA (0.47) ALDH1A1KDM4EKMT2AHPGDMEN1
SCHEMBL8082564 0.69 MEN1 (0.49) ALDH1A1KDM4EKMT2AHPGDMEN1
SCHEMBL11812036 0.69 MMP12 (0.50) ALDH1A1KDM4EKMT2AHPGDROCK2
SCHEMBL17706538 0.69 ALDH1A1 (0.52) ALDH1A1KDM4EKMT2AHPGDROCK2
SCHEMBL18163749 0.69 KDM4E (0.53) ALDH1A1KDM4EKMT2AHPGDROCK2
SCHEMBL9795277 0.68 HPGDS (0.49) ALDH1A1KDM4EKMT2AHPGDMEN1
SCHEMBL15713099 0.68 KDM4E (0.52) ALDH1A1KDM4EKMT2AHPGDROCK2

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-0363223-A2 3-Aryloxymethyl-cephalosporin derivatives, their preparation and their medical use Sankyo Company Limited (JP) 1990-04-11 — — EP claimed
US-5389626-A 3-aryloxmethyl-cephalosporin derivatives, and their medical use SANKYO COMPANY, LIMITED (JP) 1995-02-14 — — US disclosed
EP-0363223-A2 3-Aryloxymethyl-cephalosporin derivatives, their preparation and their medical use Sankyo Company Limited (JP) 1990-04-11 — — EP disclosed
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