SCHEMBL28155502

SCHEMBL28155502

O=C(NCc1ccccc1)OP(=O)(O)O

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.51
KMT2A Q03164 2/20 0.51
TP53 P04637 2/20 0.49
GAA P10253 2/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
TSHR P16473 1/20 0.49
BCHE P06276 1/20 0.48
ALDH1A1 P00352 1/20 0.47
GLA P06280 1/20 0.47
LMNA P02545 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL24487026 0.80 PLAU (0.47) HPGDKMT2ATP53GAAHDAC2
SCHEMBL8621389 0.77 GAA (0.55) HPGDKMT2ATP53GAATSHR
Phosphoric Acid SCHEMBL28155504 0.77 TSHR (0.69) HPGDKMT2ATP53GAAHDAC2
SCHEMBL1720194 0.77 ALDH1A1 (0.67) HPGDKMT2ATP53GAATSHR
SCHEMBL24486994 0.77 SMN1; SMN2 (0.46) HPGDKMT2AGAAHDAC2LMNA
SCHEMBL7202886 0.76 NPC1 (0.60) TSHR
SCHEMBL2095021 0.76 GAA (0.53) HPGDKMT2AGAATSHRBCHE
SCHEMBL1129046 0.76 CYP2D6 (0.56) HPGDKMT2AGAATSHRBCHE
SCHEMBL21201600 0.76 GAA (0.53) HPGDKMT2AGAATSHRBCHE
(Benzylamino)Carbonylphosphonic Acid SCHEMBL11569947 0.76 CA12 (0.68) HPGDKMT2ATP53GAAHDAC2

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
CN-106866727-A A kind of 2 phosphoric acid Benzylcarbamate class compound and preparation method thereof and as fluorescence probe detection of alkaline phosphatase application 广东工业大学 2017-06-20 CN disclosed
CN-106866727-A A kind of 2 phosphoric acid Benzylcarbamate class compound and preparation method thereof and as fluorescence probe detection of alkaline phosphatase application 广东工业大学 2017-06-20 CN disclosed
CN-106866727-A A kind of 2 phosphoric acid Benzylcarbamate class compound and preparation method thereof and as fluorescence probe detection of alkaline phosphatase application 广东工业大学 2017-06-20 CN disclosed