SCHEMBL11499183

SCHEMBL11499183

CCc1ccccc1CP(=O)(O)O

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ACP3 P15309 1/20 0.57
▸ PGK1 P00558 2/20 0.48
▸ PGK2 P07205 2/20 0.48
▸ TSHR P16473 2/20 0.44
▸ GABRA1 P14867 1/20 0.44
▸ GABRB2 P47870 1/20 0.44
▸ GRIN2D O15399 1/20 0.44
▸ GRIN3B O60391 1/20 0.44
▸ GRIN1 Q05586 1/20 0.44
▸ GRIN2A Q12879 1/20 0.44
▸ GRIN2B Q13224 1/20 0.44
▸ GRIN2C Q14957 1/20 0.44
▸ GRIN3A Q8TCU5 1/20 0.44
▸ MMP2 P08253 2/20 0.43
▸ MMP9 P14780 2/20 0.43
▸ MMP12 P39900 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ ENPP2 Q13822 1/20 0.40

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
SCHEMBL8053801 0.91 ACP3 (0.65) ACP3PGK1PGK2TSHRGRIN2D
SCHEMBL29707862 0.91 ACP3 (0.65) ACP3PGK1PGK2TSHRGRIN2D
Phosphoric Acid SCHEMBL28176644 0.85 GABRA1 (0.52) ACP3TSHRGABRA1GABRB2
SCHEMBL914880 0.82 ENPP2 (0.50) ACP3PGK1PGK2TSHRGRIN2D
SCHEMBL28213109 0.82 ACP3 (0.62) ACP3PGK1PGK2TSHRGRIN2D
SCHEMBL10988292 0.81 GABRA1 (0.48) ACP3TSHRGABRA1GABRB2
SCHEMBL1556934 0.81 ACP3 (0.52) ACP3PGK1PGK2GABRA1GABRB2
SCHEMBL232548 0.80 PGK1 (0.57) ACP3PGK1PGK2GRIN2DGRIN3B
SCHEMBL4836284 0.80 ACP3 (0.55) ACP3PGK1PGK2TSHRGRIN2D
Butane SCHEMBL3810051 0.79 TSHR (0.62) ACP3PGK1PGK2TSHRGRIN2D

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
EP-0019172-A1 6-Substituted 11-alkylene-morphantridines, process for preparing them and pharmaceutical compositions containing them BASF Aktiengesellschaft (DE) 1980-11-26 — — EP disclosed
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