SCHEMBL29134425

SCHEMBL29134425

COc1ccc(Br)cc1S(=O)(=O)Nc1ccc(C#N)c(Cl)c1

nearest known ligand 0.73

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 6/20 0.73
ALPL P05186 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
THRB P10828 1/20 0.53
HPGD P15428 1/20 0.53
WDR5 P61964 3/20 0.52
MYC P01106 1/20 0.52
TRIM24 O15164 1/20 0.52
BRD4 O60885 2/20 0.50
BRD2 P25440 1/20 0.50
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
HTT P42858 1/20 0.49
KMT2A Q03164 1/20 0.49
SHMT2 P34897 1/20 0.49
GLA P06280 1/20 0.49

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
SCHEMBL29134937 0.90 SLC22A12 (0.58) SLC22A12ALPLSMN1; SMN2WDR5MYC
SCHEMBL29134947 0.82 ALPL (0.58) ALPLSMN1; SMN2TRIM24BRD4BRD2
SCHEMBL329987 0.78 TP53 (0.73) ALPLSMN1; SMN2WDR5MYCKMT2A
SCHEMBL18530464 0.76 ALPL (0.70) ALPLSMN1; SMN2HPGDMEN1ALDH1A1
SCHEMBL21761109 0.75 LMNA (0.73) ALPLSMN1; SMN2HPGDMEN1ALDH1A1
SCHEMBL21760616 0.75 ALPL (0.62) ALPLSMN1; SMN2WDR5MYCTRIM24
SCHEMBL3761698 0.75 ALPL (0.72) ALPLSMN1; SMN2WDR5MEN1LMNA
SCHEMBL14018775 0.73 ALPL (0.59) ALPLSMN1; SMN2WDR5MYCBRD4
SCHEMBL4650569 0.73 SLC22A12 (0.73) SLC22A12MEN1LMNAMAPTKMT2A
SCHEMBL21761107 0.72 ALPL (0.65) ALPLSMN1; SMN2WDR5MYCBRD4

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-117120429-A KHK inhibitor 吉利德科学公司 2023-11-24 CN disclosed