SCHEMBL28937176

SCHEMBL28937176

C=Cc1cc(-c2cccc(C)c2)cn1S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 4/20 0.42
▸ GRM5 P41594 3/20 0.42
▸ MAPT P10636 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ UBE2N P61088 1/20 0.40
▸ RAPGEF4 Q8WZA2 1/20 0.38
▸ CA1 P00915 3/20 0.38
▸ CA2 P00918 3/20 0.38
▸ HTT P42858 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ ALDH3A1 P30838 1/20 0.36
▸ NOD1 Q9Y239 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ CA5A P35218 1/20 0.36
▸ CA5B Q9Y2D0 1/20 0.36
▸ PTGS1 P23219 2/20 0.36
▸ PTGS2 P35354 2/20 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
SCHEMBL28937181 0.90 L3MBTL1 (0.50) L3MBTL1MAPTKDM4EUBE2NRAPGEF4
SCHEMBL28963607 0.88 PKM (0.45) L3MBTL1MAPTKDM4EUBE2NRAPGEF4
SCHEMBL28937173 0.82 LMNA (0.44) L3MBTL1KDM4EUBE2NCA1CA2
SCHEMBL28937177 0.80 PKM (0.39) L3MBTL1KDM4EUBE2NRAPGEF4CA1
SCHEMBL28937178 0.75 RAPGEF4 (0.47) L3MBTL1TP53KDM4EUBE2NRAPGEF4
SCHEMBL28937175 0.73 CD4 (0.43) L3MBTL1KDM4EUBE2NRAPGEF4CA1
SCHEMBL5776529 0.72 RAPGEF4 (0.56) L3MBTL1KDM4EUBE2NRAPGEF4CA1
SCHEMBL1155931 0.72 KDM4E (0.46) L3MBTL1GRM5MAPTTP53KDM4E
SCHEMBL1763060 0.67 L3MBTL1 (0.40) L3MBTL1GRM5MAPTTP53KDM4E
Hydrochloric Acid SCHEMBL1157021 0.66 L3MBTL1 (0.39) L3MBTL1GRM5MAPTTP53KDM4E

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-109912487-B Method for synthesizing 1-p-toluenesulfonyl-2-vinyl-1H-pyrrole 山东理工大学 2023-01-10 — — CN disclosed
Send feedback