SCHEMBL9727045

SCHEMBL9727045

CNc1ccc(Cl)cc1C(O)c1ccccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 6/20 0.43
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
ADRB2 P07550 2/20 0.40
ADRB1 P08588 2/20 0.40
HIF1A Q16665 3/20 0.39
CYP2D6 P10635 1/20 0.39
NFKB1 P19838 1/20 0.39
BLM P54132 2/20 0.38
TOP2A P11388 1/20 0.37
TOP2B Q02880 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
LPAR1 Q92633 1/20 0.36
AOC3 Q16853 1/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
TSHR P16473 2/20 0.36

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
SCHEMBL8799319 0.85 ADRB2 (0.44) FDFT1ALDH1A1ADRB2ADRB1HIF1A
SCHEMBL10976262 0.83 ALDH1A1 (0.41) ALDH1A1KDM4EGLAGAACYP2D6
SCHEMBL13776051 0.82 KMT2A (0.40) ALDH1A1KDM4EGLAGAAMEN1
SCHEMBL8564882 0.82 KDM4E (0.49) FDFT1ALDH1A1KDM4ELPAR1LMNA
SCHEMBL8564876 0.82 KDM4E (0.49) FDFT1ALDH1A1KDM4ELPAR1LMNA
SCHEMBL8799234 0.81 FDFT1 (0.42) FDFT1ADRB2ADRB1HIF1ACYP2D6
SCHEMBL8118267 0.80 FDFT1 (0.48) FDFT1ADRB2ADRB1HIF1ACYP2D6
SCHEMBL6956611 0.77 FDFT1 (0.41) FDFT1KDM4EADRB2ADRB1HIF1A
SCHEMBL13776045 0.77 LPAR1 (0.44) ALDH1A1KDM4EGAAHIF1ACYP2D6
SCHEMBL6957617 0.76 KDM4E (0.44) FDFT1ALDH1A1KDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4076703-A 2-O-CHLOROBENZOYL-4-CHLORO-N-METHYL-N(ALPHA)-GLYCYL-GLYCINANILIDE SHIONOGI & CO., LTD. (JA) 1978-02-28 US claimed
US-5091415-A Antiulcer, antisecretory agents PIERRE FABRE MEDICAMENT (FR) 1992-02-25 US disclosed
US-5025015-A Antisecretory and antiulcer agents PIERRE FABRE MEDICAMENT (FR) 1991-06-18 US disclosed
US-4410730-A Process for the production of o-(N-monosubstituted amino)benzyl alcohols SHIONOGI & CO., LTD. (JP) 1983-10-18 US disclosed
US-4240957-A FOR USE AS SEDATIVES, MUSCLE RELAXANTS, HYPNOTICS, ANTICONVULSANTS, AND TRANQUILIZERS SHIONOGI & CO., LTD. (JP) 1980-12-23 US disclosed
US-4154727-A REACTING A GLYCINAMIDE WITH A HALOACETYL HALIDE SHIONOGI & CO., LTD. (JP) 1979-05-15 US disclosed
US-4076703-A 2-O-CHLOROBENZOYL-4-CHLORO-N-METHYL-N(ALPHA)-GLYCYL-GLYCINANILIDE SHIONOGI & CO., LTD. (JA) 1978-02-28 US disclosed
US-4076704-A 2-O-CHLOROBENZOYL-4-CHLORO-N-METHYL-N(ALPHA)-GLYCYL-GLYCINANILIDE SHIONOGI & CO., LTD. (JA) 1978-02-28 US disclosed
US-4076702-A 2-O-CHLOROBENZOYL-4-CHLORO-N-METHYL-N(ALPHA)-GLYCYL-GLYCINANILIDE SHIONOGI & CO., LTD. (JA) 1978-02-28 US disclosed
US-4076705-A 2-O-CHLOROBENZOYL-4-CHLORO-N-METHYL-N(ALPHA)-GLYCYL-GLYCINANILIDE SHIONOGI & CO., LTD. (JA) 1978-02-28 US disclosed