SCHEMBL7501346

SCHEMBL7501346

[CH2]C(=O)Nc1ccc(OCCCC)cc1OCC

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
MRGPRX1 Q96LB2 1/20 0.44
THRB P10828 2/20 0.44
EPHX1 P07099 1/20 0.43
MAPK1 P28482 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPC1 O15118 1/20 0.42
MITF O75030 1/20 0.42
RAB9A P51151 1/20 0.42
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL7501359 0.87 ALDH1A1 (0.52) KDM4ETHRBEPHX1SMN1; SMN2MEN1
SCHEMBL10789373 0.78 TDP1 (0.58) KDM4EMRGPRX1EPHX1SMN1; SMN2RAB9A
SCHEMBL7789182 0.78 LMNA (0.50) SMN1; SMN2TSHR
SCHEMBL2095920 0.77 PLK1 (0.48) TSHR
SCHEMBL2095923 0.77 PLK1 (0.50) THRBMEN1GAAKMT2ATSHR
SCHEMBL10889367 0.77 ALDH1A1 (0.52) KDM4EMRGPRX1EPHX1SMN1; SMN2MEN1
SCHEMBL7956543 0.77 KMT2A (0.66) KDM4ESMN1; SMN2NPC1RAB9AMEN1
SCHEMBL7495425 0.74 FAAH (0.60) KDM4ESMN1; SMN2GAAHPGDHTT
SCHEMBL7956472 0.74 GAA (0.71) KDM4ESMN1; SMN2NPC1RAB9AMEN1
SCHEMBL7517447 0.74 KMT2A (0.50) THRBNPC1RAB9AMEN1KMT2A

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-0638075-B1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMA CO LTD (JP) 2002-01-16 EP disclosed
WO-1998043649-A2 AGE PRODUCTION INHIBITORY COMPOSITION COMPRISING A MAILLARD REACTION INHIBITOR AND VITAMIN B¿6? OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-10-08 WO disclosed
US-5677322-A THERAPY FOR AGING, DIABETES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-10-14 US disclosed