SCHEMBL28470752

SCHEMBL28470752

CCn1nccc1OS(C)(=O)=O

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 3/20 0.33
NPC1 O15118 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 2/20 0.33
HTT P42858 2/20 0.33
GCK P35557 4/20 0.32
KIT P10721 1/20 0.32
CCNK O75909 1/20 0.31
CDK12 Q9NYV4 1/20 0.31

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
SCHEMBL28891654 0.80 PTGS2 (0.36)
SCHEMBL28464756 0.79 SMN1; SMN2 (0.43) L3MBTL1SMN1; SMN2ALDH1A1RAB9ANPC1
SCHEMBL27982877 0.77
SCHEMBL28477181 0.76 OXTR (0.36) L3MBTL1SMN1; SMN2KMT2ARAB9AHTT
SCHEMBL27691368 0.70 L3MBTL1 (0.42) L3MBTL1SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL28960954 0.68
SCHEMBL29813556 0.67 KIT (0.38) L3MBTL1SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL9069074 0.67 SMN1; SMN2 (0.38) L3MBTL1SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL7697126 0.66
SCHEMBL31192843 0.66 KDM5A (0.46) L3MBTL1SMN1; SMN2MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111808024-B Phenyl pyrazolone compound or salt thereof, preparation method and application 郑州手性药物研究院有限公司 2023-06-27 CN disclosed
CN-111808024-A Phenylpyrazolone compound or salt thereof, preparation method and application 郑州手性药物研究院有限公司 2020-10-23 CN disclosed