SCHEMBL25142154

SCHEMBL25142154

N#CSc1ccccc1Br

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.40
WDR5 P61964 1/20 0.40
HTR7 P34969 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
LMNA P02545 1/20 0.36
USP2 O75604 1/20 0.35
USP8 P40818 1/20 0.35
USP5 P45974 1/20 0.35
USP4 Q13107 1/20 0.35
USP7 Q93009 1/20 0.35
CYP1A2 P05177 3/20 0.33
ALDH1A1 P00352 3/20 0.33
CYP1A1 P04798 2/20 0.33
CYP1B1 Q16678 2/20 0.33
CA2 P00918 1/20 0.32
CA5A P35218 1/20 0.32
PDE7A Q13946 4/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 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
SCHEMBL8763537 0.82 USP2 (0.42) MYCWDR5MAOAMAOBLMNA
SCHEMBL21088928 0.74 HTR7 (0.38) HTR7MAOAMAOBLMNACYP1A2
SCHEMBL9751834 0.73 USP2 (0.37) LMNAUSP2USP8USP5USP4
SCHEMBL3307820 0.73 USP2 (0.37) LMNAUSP2USP8USP5USP4
SCHEMBL26944306 0.73 USP2 (0.38) MYCWDR5MAOAMAOBLMNA
SCHEMBL1145380 0.72
SCHEMBL231786 0.71 TSHR (0.44) USP2USP8USP5USP4USP7
SCHEMBL5490899 0.71 ALDH1A1 (0.41) LMNAUSP2USP8USP5USP4
SCHEMBL11241316 0.71 CYP1A2 (0.53) MAOAMAOBLMNAUSP2USP8
SCHEMBL1664376 0.71 MAPT (0.54) LMNAUSP2USP8USP5USP4

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
US-20230117674-A1 MICROFLUIDIC REACTOR FOR CONTROLLING CHEMICAL REACTION AND CHEMICAL REACTION CONTROL METHOD USING THE SAME POSTECH Research and Business Development Foundation (KR) 2023-04-20 US disclosed