SCHEMBL21754522

SCHEMBL21754522

O=P(O)(O)CN(Cc1ccc(O)cc1)CP(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.47
ESR1 P03372 4/20 0.39
ESR2 Q92731 3/20 0.39
CA2 P00918 4/20 0.38
CAMK2A Q9UQM7 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
MMP2 P08253 1/20 0.37
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
ABAT P80404 1/20 0.37
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALDH2 P05091 1/20 0.36
MTOR P42345 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
SCHEMBL13496886 0.82 ANPEP (0.44) CA2CA12CA1ABATHDAC8
SCHEMBL743742 0.82 FDPS (0.47) PTPN1ACHEHDAC8HDAC6ALDH1A1
SCHEMBL1655196 0.82 LAP3 (0.46) CA2ALDH1A1
SCHEMBL2988813 0.81 ESR1 (0.46) PTPN1ESR1ESR2CA2ALDH1A1
SCHEMBL10383331 0.80 LAP3 (0.44) PTPN1CA2ALDH1A1
SCHEMBL13970794 0.79 MEP1B (0.54) PTPN1HDAC8HDAC6ALDH1A1ALDH2
SCHEMBL21754525 0.78 APLNR (0.49) ACHEALDH1A1
SCHEMBL16350491 0.78 GAA (0.38) PTPN1ESR1ESR2BCHEACHE
SCHEMBL13422988 0.78 ALDH1A1 (0.38) HDAC8HDAC6ALDH1A1
SCHEMBL29369685 0.78 ESR1 (0.55) ESR1ESR2CA2CAMK2ACA12

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12037287-B2 High-adaptability viscosity-reducing polycarboxylic acid water reducer, preparation method therefor and use thereof SOBUTE NEW MATERIALS CO., LTD (CN) 2024-07-16 US disclosed
US-12037287-B2 High-adaptability viscosity-reducing polycarboxylic acid water reducer, preparation method therefor and use thereof SOBUTE NEW MATERIALS CO., LTD (CN) 2024-07-16 US disclosed
US-20210163355-A1 HIGH-ADAPTABILITY VISCOSITY-REDUCING POLYCARBOXYLIC ACID WATER REDUCER, PREPARATION METHOD THEREFOR AND USE THEREOF SOBUTE NEW MATERIALS CO.,LTD. (CN) 2021-06-03 US disclosed
US-10570253-B2 Preparation method for polymer and applications thereof SOBUTE NEW MATERIALS CO., LTD. (CN) 2020-02-25 US disclosed