SCHEMBL5833643

SCHEMBL5833643

Cc1ccc2c(C(=O)O)ccc(C(=O)O)c2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.55
LDHA P00338 3/20 0.50
LDHB P07195 3/20 0.50
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 3/20 0.47
HSD17B10 Q99714 1/20 0.47
ACE2 Q9BYF1 2/20 0.47
ALB P02768 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MCL1 Q07820 2/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
MAOB P27338 1/20 0.43
CA5A P35218 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43

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
SCHEMBL10812888 0.88 CSNK2A1 (0.63) CSNK2A1LDHALDHBALDH1A1KDM4E
SCHEMBL18281167 0.80 MEN1 (0.53) CSNK2A1LDHALDHBALDH1A1KDM4E
SCHEMBL467550 0.79 CSNK2A1 (0.68) CSNK2A1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL31627797 0.79 CSNK2A1 (0.68) CSNK2A1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL11338245 0.79 CYP1A2 (0.48) CSNK2A1LDHALDHBALDH1A1KDM4E
SCHEMBL489010 0.78 CSNK2A1 (0.61) CSNK2A1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL7495328 0.78 CYP1A2 (0.58) LDHAALDH1A1KDM4EHSD17B10ACE2
SCHEMBL6234004 0.77 CSNK2A1 (0.65) CSNK2A1ALDH1A1KDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL302205 0.77 CSNK2A1 (0.65) CSNK2A1ALDH1A1KDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL6633682 0.77 CSNK2A1 (0.65) CSNK2A1ALDH1A1KDM4EMEN1KMT2A

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-2048152-A1 FUSED RING SPIROKETAL DERIVATIVE AND USE THEREOF AS DRUG FOR TREATING DIABETES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2009-04-15 EP disclosed
US-20060210812-A1 Insulating film and method of forming the same JSR CORPORATION (JP) 2006-09-21 US disclosed
EP-1696478-A1 INSULATING FILM, METHOD FOR FORMING SAME AND COMPOSITION FOR FORMING FILM JSR Corporation (JP) 2006-08-30 EP disclosed