SCHEMBL1448532

SCHEMBL1448532

CN(C)C=CC(=O)c1ccc(P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.72
MAPT P10636 10/20 0.66
ALDH1A1 P00352 9/20 0.66
SMN1; SMN2 Q16637 3/20 0.66
GAA P10253 3/20 0.66
RAB9A P51151 6/20 0.63
POLB P06746 4/20 0.63
NPC1 O15118 3/20 0.63
HSP90AA1 P07900 2/20 0.63
LMNA P02545 5/20 0.58
HPGD P15428 3/20 0.58
CYP1A2 P05177 2/20 0.58
CYP2C19 P33261 2/20 0.58
ALOX12 P18054 1/20 0.58
HTT P42858 4/20 0.54
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.51

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
SCHEMBL12742913 1.00 RECQL (0.72) RECQLMAPTALDH1A1SMN1; SMN2GAA
SCHEMBL1449217 0.86 RECQL (0.66) RECQLMAPTALDH1A1SMN1; SMN2GAA
SCHEMBL14063274 0.86 RECQL (0.66) RECQLMAPTALDH1A1SMN1; SMN2GAA
SCHEMBL12742903 0.86 RECQL (0.66) RECQLMAPTALDH1A1SMN1; SMN2GAA
SCHEMBL425338 0.84 RECQL (1.00) RECQLMAPTALDH1A1SMN1; SMN2GAA
SCHEMBL446006 0.84 RECQL (1.00) RECQLMAPTALDH1A1SMN1; SMN2GAA
SCHEMBL29176317 0.84 RECQL (1.00) RECQLMAPTALDH1A1SMN1; SMN2GAA
SCHEMBL23251385 0.82 MAPT (0.81) RECQLMAPTALDH1A1SMN1; SMN2GAA
SCHEMBL12275056 0.81 RECQL (0.79) RECQLMAPTALDH1A1SMN1; SMN2GAA
SCHEMBL12275054 0.81 RECQL (0.79) RECQLMAPTALDH1A1SMN1; SMN2GAA

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
US-7910744-B2 Pyrazole and Pyrimidine groups are introduced on aromatic phosphine; (3-bromophenyl)methyl ketone and ethylene glycol cyclize to [3-(2-methyl-1,3-dioxolane-2-yl)phenyl]diphenylphosphane; adding hydrazine monohydrate, then oxidizing with hydrogen peroxide; [3-(3-Pyrazolyl)phenyl]diphenylphosphane oxide ZYLUM BETEILIGUNGSGESELLSCHAFT MBH & CO. PATENT II KG (DE) 2011-03-22 US disclosed