SCHEMBL27300022

SCHEMBL27300022

N#Cc1ccc(Oc2ccc(Cl)cc2F)nc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.47
FEN1 P39748 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
SLC22A12 Q96S37 3/20 0.43
HSPB1 P04792 1/20 0.41
GRM4 Q14833 1/20 0.40
SLC6A4 P31645 3/20 0.39
KCNH2 Q12809 2/20 0.39
SLC6A2 P23975 2/20 0.39
PDE4B Q07343 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TMPRSS4 Q9NRS4 1/20 0.38
CYP19A1 P11511 1/20 0.38
SLC6A3 Q01959 2/20 0.38
MET P08581 1/20 0.37
GRM5 P41594 2/20 0.37
MRGPRX4 Q96LA9 1/20 0.36

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
SCHEMBL27295442 0.86 HSPB1 (0.56) ALOX5APFEN1SLC22A12HSPB1PDE4B
SCHEMBL31473415 0.86 HSPB1 (0.56) ALOX5APFEN1SLC22A12HSPB1PDE4B
SCHEMBL753498 0.81 SLC6A4 (0.50) SLC22A12SLC6A4KCNH2SLC6A2CYP19A1
SCHEMBL3696686 0.80 ALOX5AP (0.47) ALOX5APFEN1L3MBTL1SLC22A12HSPB1
SCHEMBL27300363 0.80 ALOX5AP (0.55) ALOX5APFEN1SLC22A12HSPB1PDE4B
SCHEMBL31473343 0.80 KMT2A (0.60) ALOX5APFEN1L3MBTL1SLC22A12HSPB1
SCHEMBL27295176 0.80 KMT2A (0.60) ALOX5APFEN1L3MBTL1SLC22A12HSPB1
SCHEMBL31399235 0.78 MRGPRX4 (0.43) SLC22A12SLC6A4KCNH2TMPRSS4CYP19A1
SCHEMBL26126058 0.78 MRGPRX4 (0.43) SLC22A12SLC6A4KCNH2TMPRSS4CYP19A1
SCHEMBL3131610 0.78 MERTK (0.46) SLC6A4KCNH2SLC6A2MEN1KMT2A

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
WO-2024029489-A1 KIT INHIBITORS, COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF MODULUS DISCOVERY, INC. (JP) 2024-02-08 WO disclosed