SCHEMBL11501606

SCHEMBL11501606

Nc1cc(CP(=O)(O)O)ccc1CP(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 10/20 0.43
PGK2 P07205 10/20 0.43
ACP3 P15309 1/20 0.42
FBP1 P09467 1/20 0.40
ENPP2 Q13822 1/20 0.40
PTPRB P23467 2/20 0.39

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
SCHEMBL6895733 0.84 PGK1 (0.40) PGK1PGK2ACP3
SCHEMBL11350761 0.82 PGK1 (0.44) PGK1PGK2ACP3
SCHEMBL8824572 0.82 PGK1 (0.47) PGK1PGK2ACP3ENPP2PTPRB
SCHEMBL10482359 0.77 ENPP2 (0.47) PGK1PGK2ACP3ENPP2PTPRB
SCHEMBL2637218 0.76 CYP3A4 (0.57) PGK1PGK2ACP3
SCHEMBL9277395 0.76 ACP3 (0.45) PGK1PGK2ACP3FBP1
SCHEMBL2637236 0.76 PGK1 (0.42) PGK1PGK2ACP3FBP1ENPP2
SCHEMBL9275830 0.76 PGK1 (0.50) PGK1PGK2ACP3ENPP2
SCHEMBL233490 0.74 FDPS (0.56) PGK1PGK2ACP3
SCHEMBL1617420 0.73 PGK1 (0.67) PGK1PGK2ACP3ENPP2PTPRB

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
US-4150020-A MONOAZO DYES BURLINGTON INDUSTRIES, INC. (US) 1979-04-17 US disclosed
US-4134722-A Reactive dyeing system using phosphorus acid dyes with a cyanamide compound BURLINGTON INDUSTRIES, INC. (US) 1979-01-16 US disclosed
US-4098784-A REACTIVE LINKING TO CELLULOSE BURLINGTON INDUSTRIES, INC. (US) 1978-07-04 US disclosed