SCHEMBL8790808

SCHEMBL8790808

CC(=O)On1nnnc1-c1ccc(Br)s1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
POLB P06746 3/20 0.38
LMNA P02545 2/20 0.38
ABL1 P00519 1/20 0.38
ALDH1A1 P00352 3/20 0.37
RXFP1 Q9HBX9 6/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
TGM2 P21980 1/20 0.33
TGM1 P22735 1/20 0.33
MAPT P10636 3/20 0.33
PPARG P37231 2/20 0.33
NCOA2 Q15596 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALOX12 P18054 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33

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
SCHEMBL8789847 0.88 DAO (0.33) KDM4EALDH1A1MEN1KMT2ANPC1
SCHEMBL8791435 0.84 RPS6KB2 (0.30)
SCHEMBL8791363 0.83 NQO2 (0.42) KDM4EPOLBALDH1A1RXFP1MEN1
SCHEMBL8791157 0.82 PKM (0.36) ALDH1A1HPGD
SCHEMBL8790916 0.82 KMT2A (0.38) KDM4ELMNAALDH1A1RXFP1MEN1
SCHEMBL8790908 0.80 DPP4 (0.38) KDM4ELMNAALDH1A1L3MBTL1HPGD
SCHEMBL8791239 0.78 POLB (0.38) KDM4EPOLBLMNAALDH1A1KMT2A
SCHEMBL8791911 0.78 MAPT (0.33) KDM4EPOLBALDH1A1MEN1KMT2A
SCHEMBL8790766 0.77 KMT2A (0.48) KDM4EALDH1A1KMT2ANPC1RAB9A
SCHEMBL8791208 0.75 MAPK8 (0.34) ALDH1A1RXFP1NPSR1HPGDHIF1A

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-0421365-B1 Tetrazoleacetic acid derivatives having aldose reductase inhibitory activity WAKAMOTO PHARMA CO LTD (JP) 1997-03-05 EP disclosed
US-RE35321-E ANTIDIABETIC AGENT WAKAMOTO PHARMACEUTICAL CO., LTD. (JP) 1996-08-27 US disclosed
US-5068239-A Antidiabetic agent WAKAMOTO PHARMACEUTICAL CO., LTD. (JP) 1991-11-26 US disclosed