SCHEMBL21754525

SCHEMBL21754525

COc1ccc(CN(CP(=O)(O)O)CP(=O)(O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
APLNR P35414 2/20 0.49
ALDH1A1 P00352 2/20 0.47
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ANPEP P15144 2/20 0.47
ERAP2 Q6P179 2/20 0.47
ACHE P22303 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ACP3 P15309 1/20 0.44
USP2 O75604 1/20 0.43
TSHR P16473 1/20 0.43
TSPO P30536 1/20 0.43
PYCR1 P32322 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
LDHA P00338 1/20 0.42
TDP1 Q9NUW8 2/20 0.41

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
SCHEMBL13052639 0.83 AOC3 (0.51) ALDH1A1SMN1; SMN2ANPEPERAP2TSHR
SCHEMBL12049800 0.79 APLNR (0.59) APLNRALDH1A1HTTSMN1; SMN2ACHE
SCHEMBL5270803 0.79 APLNR (0.59) APLNRALDH1A1HTTSMN1; SMN2ACHE
SCHEMBL21754522 0.78 PTPN1 (0.47) ALDH1A1ACHE
SCHEMBL13496886 0.77 ANPEP (0.44) ANPEPERAP2
SCHEMBL743742 0.77 FDPS (0.47) ALDH1A1ANPEPERAP2ACHETSHR
SCHEMBL16350500 0.76 AOC3 (0.44) ALDH1A1SMN1; SMN2ANPEPERAP2TSHR
SCHEMBL914654 0.76 ANPEP (0.53) HTTANPEPERAP2ACP3LDHA
SCHEMBL1655196 0.76 LAP3 (0.46) ALDH1A1ANPEPERAP2MEN1KMT2A
SCHEMBL18942071 0.75 ALDH1A1 (0.54) APLNRALDH1A1HTTSMN1; SMN2ACHE

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