SCHEMBL28031135

SCHEMBL28031135

Cc1ccc2c(c1)c(OP(C)(=O)O)nc1ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.42
▸ NQO2 P16083 1/20 0.39
▸ MAOA P21397 1/20 0.39
▸ KMT2A Q03164 9/20 0.38
▸ MEN1 O00255 8/20 0.38
▸ GAA P10253 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ MAPT P10636 4/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ CREBBP Q92793 1/20 0.37
▸ USP2 O75604 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ MCL1 Q07820 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36

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
SCHEMBL28031691 0.90 KDM4E (0.41) NQO2MAOAKMT2AMEN1ALDH1A1
SCHEMBL28031133 0.89 GPR3 (0.45) GPR3NQO2MAOAKMT2AMEN1
SCHEMBL28822266 0.87 GPR3 (0.47) GPR3KMT2AMEN1KDM4EHSD17B10
SCHEMBL28031751 0.85 GPR3 (0.38) GPR3KMT2AMEN1KDM4EHTT
SCHEMBL28031124 0.85 DHODH (0.39) GPR3KDM4ESMN1; SMN2
SCHEMBL28031125 0.84 KDM4E (0.44) NQO2KMT2AMEN1GAAALDH1A1
SCHEMBL28031746 0.82 MAT2A (0.39) GPR3
SCHEMBL28031665 0.81 PDE10A (0.40) GPR3KMT2AMEN1GAAALDH1A1
SCHEMBL28031690 0.79 NQO2 (0.42) GPR3NQO2MAOAKMT2AMEN1
SCHEMBL28031193 0.77 ALDH1A1 (0.38) GPR3KMT2AMEN1ALDH1A1KDM4E

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
CN-104844651-A Method for preparing six fluorine phosphonic acid ester base fe organism derivatives UNIV LUOYANG NORMAL 2015-08-19 — — CN disclosed
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