SCHEMBL28290788

SCHEMBL28290788

C=CC(=O)N(c1ccccc1)S(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
AKT1 P31749 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.37
ESR1 P03372 2/20 0.36
TGM2 P21980 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.34
HPGD P15428 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
HSP90AA1 P07900 1/20 0.33
BCL2A1 Q16548 1/20 0.33
S1PR1 P21453 1/20 0.33

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
SCHEMBL30584111 0.85 KMT2A (0.43) KMT2AAKT1NPSR1TRPM8ESR1
SCHEMBL11325801 0.80 KMT2A (0.44) KMT2ANPSR1ESR1SMN1; SMN2ALDH1A1
SCHEMBL8365251 0.80 ESR1 (0.36) KMT2AAKT1NPSR1TRPM8ESR1
SCHEMBL3045678 0.78 KMT2A (0.46) KMT2ANPSR1ESR1SMN1; SMN2ALDH1A1
SCHEMBL27487172 0.75 KMT2A (0.43) KMT2ANPSR1ESR1SMN1; SMN2ALDH1A1
SCHEMBL18281626 0.75 KMT2A (0.61) KMT2ANPSR1SMN1; SMN2ALDH1A1LMNA
SCHEMBL1629579 0.74 TRPM8 (0.57) KMT2AAKT1NPSR1TRPM8TGM2
SCHEMBL17591554 0.74 AKT1 (0.52) KMT2AAKT1NPSR1TRPM8TGM2
SCHEMBL27502344 0.73 KMT2A (0.42) KMT2ANPSR1ESR1SMN1; SMN2ALDH1A1
SCHEMBL648421 0.72 AKT1 (0.45) KMT2AAKT1NPSR1TRPM8TGM2

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-109706727-A A kind of good color-woven fabric of feel and its preparation process 王世茸 2019-05-03 CN claimed