SCHEMBL29486806

SCHEMBL29486806

O=[N+]([O-])c1cnc2c(cc(Br)n2S(=O)(=O)c2ccccc2)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DCTPP1 Q9H773 1/20 0.42
KIF18A Q8NI77 1/20 0.38
PTGDR2 Q9Y5Y4 3/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 2/20 0.37
VCAM1 P19320 3/20 0.37
RAB9A P51151 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
SRC P12931 1/20 0.36
NPBWR1 P48145 1/20 0.35
MCHR1 Q99705 1/20 0.35
WNK1 Q9H4A3 1/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
SLC25A1 P53007 1/20 0.35
PIN1 Q13526 2/20 0.34

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
SCHEMBL24164979 1.00 DCTPP1 (0.42) DCTPP1KIF18APTGDR2KMT2AMEN1
SCHEMBL24165289 0.84 PTGDR2 (0.36) DCTPP1KIF18APTGDR2KMT2AMEN1
SCHEMBL24165220 0.81 BRD4 (0.39) DCTPP1PTGDR2KMT2AMEN1RAB9A
SCHEMBL30368149 0.81 BRD4 (0.39) DCTPP1PTGDR2KMT2AMEN1RAB9A
SCHEMBL21490482 0.79 HSD11B1 (0.40) DCTPP1PTGDR2KMT2AMEN1VCAM1
SCHEMBL24165525 0.79 DCTPP1 (0.39) DCTPP1KIF18APTGDR2KMT2AMEN1
SCHEMBL2273205 0.78 CYP2C19 (0.44) DCTPP1KIF18AKMT2AMEN1VCAM1
SCHEMBL29428770 0.78 CYP2C19 (0.44) DCTPP1KIF18AKMT2AMEN1VCAM1
SCHEMBL31089880 0.76 SRC (0.35) DCTPP1PTGDR2ALDH1A1SRC
SCHEMBL12384877 0.75 DCTPP1 (0.42) DCTPP1KIF18AKMT2AMEN1RAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4175719-A1 TRICYCLIC UREA COMPOUNDS AS JAK2 V617F INHIBITORS Incyte Corporation (US) 2023-05-10 EP disclosed
WO-2022046989-A1 TRICYCLIC UREA COMPOUNDS AS JAK2 V617F INHIBITORS INCYTE CORPORATION (US) 2022-03-03 WO disclosed