SCHEMBL8790908

SCHEMBL8790908

COCc1ccc(-c2nnnn2OC(C)=O)s1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.38
GRIN1 Q05586 3/20 0.37
GRIN2B Q13224 3/20 0.37
RPS6KB2 Q9UBS0 1/20 0.32
KCNN4 O15554 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
HSD11B1 P28845 2/20 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
SCHEMBL8790916 0.87 KMT2A (0.38) GRIN1GRIN2BKDM4EALDH1A1LMNA
SCHEMBL8791435 0.86 RPS6KB2 (0.30) RPS6KB2
SCHEMBL8791911 0.83 MAPT (0.33) RPS6KB2KDM4EALDH1A1
SCHEMBL8791239 0.83 POLB (0.38) KDM4EALDH1A1LMNA
SCHEMBL8789847 0.83 DAO (0.33) KDM4EALDH1A1HPGDHSD11B1
SCHEMBL8790808 0.80 KDM4E (0.38) KDM4EALDH1A1LMNAHPGDL3MBTL1
SCHEMBL8791363 0.78 NQO2 (0.42) KDM4EALDH1A1HPGDHSD11B1
SCHEMBL9845581 0.78 ALDH1A1 (0.47) DPP4GRIN1GRIN2BKDM4EALDH1A1
SCHEMBL8791157 0.77 PKM (0.36) ALDH1A1HPGD
SCHEMBL8973496 0.73 POLB (0.32) ALDH1A1LMNA

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 4 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
EP-0421365-A2 Tetrazoleacetic acid derivatives having aldose reductase inhibitory activity Wakamoto Pharmaceutical Co., Ltd. (JP) 1991-04-10 EP disclosed