SCHEMBL28678392

SCHEMBL28678392

CCCCC#C[PH](=O)C#CCCCC

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 3/20 0.38
TSHR P16473 2/20 0.38
PTPN7 P35236 5/20 0.35
RECQL P46063 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
ALOX12 P18054 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
MCL1 Q07820 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.30

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
SCHEMBL55033 0.73 TSHR (0.53) HMGCRTSHRPTPN7RECQLTDP1
SCHEMBL11854278 0.70 TSHR (0.50) HMGCRTSHRPTPN7RECQLTDP1
SCHEMBL131292 0.69
SCHEMBL127557 0.69
SCHEMBL7082010 0.69 HMGCR (0.34) HMGCRTSHRPTPN7RECQLTDP1
SCHEMBL27895997 0.68
SCHEMBL56364 0.67
SCHEMBL5166944 0.67
SCHEMBL302816 0.67 HMGCR (0.56) HMGCRTSHRPTPN7RECQLTDP1
SCHEMBL303102 0.67 PTPN7 (0.54) HMGCRTSHRPTPN7RECQLTDP1

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-110330526-B Green synthesis method of thiophosphite 成都理工大学 2021-11-26 CN disclosed