SCHEMBL28297049

SCHEMBL28297049

Cc1sccc1C(=O)Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 9/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
P2RX1 P51575 2/20 0.60
KMT2A Q03164 2/20 0.59
PTGS1 P23219 1/20 0.59
MAPT P10636 2/20 0.58
LCK P06239 1/20 0.56
KIT P10721 1/20 0.56
SRC P12931 1/20 0.56
KDR P35968 1/20 0.56
MAPK14 Q16539 1/20 0.56
NPSR1 Q6W5P4 1/20 0.55
HSD17B10 Q99714 1/20 0.55
NAMPT P43490 1/20 0.55
MEN1 O00255 1/20 0.55
HTT P42858 1/20 0.55
RAB9A P51151 1/20 0.55
SLC2A1 P11166 1/20 0.55
P2RX4 Q99571 1/20 0.55
P2RX7 Q99572 1/20 0.55

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
SCHEMBL2185804 0.83 KMT2A (0.59) RXFP1SMN1; SMN2P2RX1KMT2APTGS1
SCHEMBL2186132 0.83 P2RX1 (0.55) RXFP1SMN1; SMN2P2RX1KMT2APTGS1
SCHEMBL4147912 0.81 P2RX1 (0.56) RXFP1SMN1; SMN2P2RX1KMT2APTGS1
SCHEMBL2211815 0.81 KMT2A (0.58) RXFP1P2RX1KMT2APTGS1MAPT
SCHEMBL12544169 0.80 RXFP1 (0.88) RXFP1SMN1; SMN2P2RX1KMT2APTGS1
SCHEMBL14394718 0.79 P2RX1 (0.78) RXFP1SMN1; SMN2P2RX1KMT2APTGS1
SCHEMBL11344615 0.78 NAMPT (0.68) SMN1; SMN2KMT2AMAPTHSD17B10NAMPT
SCHEMBL22066205 0.78 RXFP1 (0.79) RXFP1SMN1; SMN2P2RX1KMT2APTGS1
SCHEMBL16127831 0.78 RXFP1 (0.76) RXFP1P2RX1PTGS1MAPT
SCHEMBL28103851 0.78 RXFP1 (0.57) RXFP1SMN1; SMN2P2RX1KMT2APTGS1

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-105960400-B Sulfamoylthiophene amide derivatives and its purposes for being used to treat hepatitis B as drug 爱尔兰詹森科学公司 2019-05-31 CN disclosed