SCHEMBL23794893

SCHEMBL23794893

Clc1ccc(Nc2ccon2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
IDO1 P14902 1/20 0.46
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
FFAR2 O15552 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TSHR P16473 1/20 0.44
P2RX3 P56373 2/20 0.42
LMNA P02545 2/20 0.41
HPGD P15428 2/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
KCNH2 Q12809 2/20 0.41
SCN9A Q15858 2/20 0.41
SCN5A Q14524 1/20 0.41
POLB P06746 1/20 0.40
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL23794887 0.80 RAB9A (0.60) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL5788078 0.80 RAB9A (0.43) MAPTIDO1MEN1KMT2ASMN1; SMN2
SCHEMBL23794894 0.80 AURKA (0.49) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL23794891 0.80 MAPK10 (0.50) MAPTMEN1KMT2ASMN1; SMN2TSHR
SCHEMBL5765529 0.79 KMT2A (0.50) MAPTMEN1KMT2ASMN1; SMN2TSHR
SCHEMBL23794897 0.76 ROCK1 (0.51) MAPTIDO1MEN1KMT2ASMN1; SMN2
SCHEMBL23794892 0.76 KMT2A (0.48) KMT2AKCNH2SCN9ASCN5A
SCHEMBL23794896 0.76 RAB9A (0.59) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL20600105 0.72 KDM1A (0.61) MAPTMEN1KMT2ASMN1; SMN2TSHR
SCHEMBL5801454 0.70 CA1 (0.47)

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
EP-3876933-A1 NEUTROPHIL INFLAMMATION INHIBITOR AND USES THEREOF Chang Gung University of Science and Technology (TW) 2021-09-15 EP disclosed