SCHEMBL9218773

SCHEMBL9218773

CC(c1ccc(Br)cc1)n1nc(CC(=O)O)c2ccccc2c1=O

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.69
AKR1B1 P15121 15/20 0.59
MAPT P10636 1/20 0.53
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CMA1 P23946 1/20 0.42

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
SCHEMBL9216689 0.74 KMT2A (0.72) AKR1B1MAPTKMT2AMEN1CYP1A2
SCHEMBL23915519 0.73 POLB (0.67) POLBAKR1B1MAPTKMT2A
SCHEMBL15597471 0.72 MAPT (0.68) POLBMAPTKMT2AMEN1
SCHEMBL6294641 0.71 AKR1B1 (0.75) POLBAKR1B1
SCHEMBL18900937 0.70 CMA1 (0.73) POLBAKR1B1CMA1
SCHEMBL6890822 0.70 MAPT (1.00) POLBAKR1B1MAPTKMT2A
SCHEMBL9327258 0.69 MAPT (0.78) POLBAKR1B1MAPTKMT2ACMA1
SCHEMBL23914949 0.69 MAPT (0.67) POLBAKR1B1MAPTKMT2A
SCHEMBL9215584 0.69 AKR1B1 (0.77) AKR1B1MAPTKMT2AMEN1CYP1A2
SCHEMBL9218514 0.68 AKR1B1 (0.80) AKR1B1MAPTKMT2AMEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1995003053-A1 OXOPHTHALAZINES FOR TREATING CACHEXIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-02-02 WO disclosed