SCHEMBL28512677

SCHEMBL28512677

C=CCCOP(=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
AOX1 Q06278 1/20 0.42
KDM4E B2RXH2 1/20 0.41
TSHR P16473 2/20 0.41
ALOX15 P16050 1/20 0.41
CA2 P00918 2/20 0.41
ALDH1A1 P00352 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
PKM P14618 1/20 0.40
LMNA P02545 1/20 0.39
ELANE P08246 1/20 0.38
CFTR P13569 1/20 0.35
ACHE P22303 1/20 0.35
CA4 P22748 1/20 0.34
CA5A P35218 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL778514 0.85 ALOX15 (0.46) MEN1KMT2AAOX1KDM4ETSHR
SCHEMBL778515 0.82 TSHR (0.47) MEN1KMT2AAOX1KDM4ETSHR
SCHEMBL4378891 0.82 MEN1 (0.76) MEN1KMT2ATSHRCA2ALDH1A1
SCHEMBL4948416 0.81 MEN1 (0.53) MEN1KMT2AAOX1TSHRALOX15
SCHEMBL16047001 0.78 MEN1 (0.70) MEN1KMT2ACA2ALDH1A1L3MBTL1
SCHEMBL7203378 0.78 MEN1 (0.70) MEN1KMT2ACA2ALDH1A1L3MBTL1
SCHEMBL38661849 0.76 MEN1 (0.68) MEN1KMT2ACA2ALDH1A1L3MBTL1
SCHEMBL16588474 0.75 SRC (0.41) MEN1KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL19944676 0.75 THRB (0.58) MEN1KMT2ATSHRALOX15CA2
SCHEMBL28621705 0.75 MEN1 (0.66) MEN1KMT2ATSHRCA2ALDH1A1

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-106749396-B Method for preparing organic phosphonate compound by efficiently esterifying compound containing P (O) -OH and alcohol 湖南理工学院 2020-12-15 CN disclosed