SCHEMBL9366646

SCHEMBL9366646

O=c1cc(CO)[nH]cc1OC(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.33
TYR P14679 1/20 0.32
DNMT1 P26358 2/20 0.32
CYP2C19 P33261 1/20 0.32
DNMT3B Q9UBC3 1/20 0.32
PKM P14618 1/20 0.32
KMT2A Q03164 1/20 0.32
LTB4R Q15722 1/20 0.31
LTB4R2 Q9NPC1 1/20 0.31
ADRA2A P08913 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
DAO P14920 1/20 0.31
TEAD4 Q15561 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
SCHEMBL71120 0.75 GSTP1 (0.44) CYP2C19KMT2A
SCHEMBL1686913 0.71 KMT2A (0.48) TYRCYP2C19KMT2ADAOTEAD4
SCHEMBL1686843 0.71 COMT (0.41) SRD5A2TEAD4
SCHEMBL1686852 0.69 COMT (0.40) LTB4RLTB4R2
SCHEMBL6181240 0.69 COMT (0.40) SRD5A2LTB4RLTB4R2TEAD4
SCHEMBL9367581 0.68 COMT (0.37) CYP2C19KMT2A
SCHEMBL9366982 0.68 COMT (0.38) SRD5A2LTB4RLTB4R2TEAD4
SCHEMBL1686711 0.68 COMT (0.38) SRD5A2LTB4RLTB4R2TEAD4
SCHEMBL9370311 0.67 COMT (0.38) SRD5A2KMT2ALTB4RLTB4R2
SCHEMBL28898227 0.67 DAO (0.43) SRD5A2CYP2C19KMT2ADAO

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