SCHEMBL20431316

SCHEMBL20431316

COc1c(Br)cc(SI)cc1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 2/20 0.46
▸ CA4 P22748 2/20 0.46
▸ MAPT P10636 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.37
▸ TPMT P51580 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ APOBEC3A P31941 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ APOBEC3G Q9HC16 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA6 P23280 1/20 0.35
▸ NQO2 P16083 1/20 0.35
▸ HTR2A P28223 4/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.33
▸ TTR P02766 1/20 0.33
▸ INSR P06213 1/20 0.33
▸ IGF1R P08069 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
SCHEMBL22693914 0.81 CA2 (0.50) CA2CA4MAPTHPGDHSD17B10
SCHEMBL18593938 0.74 ACHE (0.52) MAPTHPGDL3MBTL1HTTHTR2A
SCHEMBL2398559 0.73 CA2 (0.58) CA2CA4MAPTHPGDHSD17B10
SCHEMBL1119927 0.72 CA2 (0.56) CA2CA4MAPTHPGDHSD17B10
SCHEMBL301662 0.72 HSD17B10 (0.59) CA2CA4MAPTHPGDHSD17B10
SCHEMBL7213113 0.71 CA2 (0.50) CA2CA4MAPTHSD17B10POLB
SCHEMBL3683983 0.70 CA2 (0.54) CA2CA4MAPTHPGDHSD17B10
SCHEMBL28647762 0.69 CA2 (0.75) CA2CA4MAPTHPGDHSD17B10
SCHEMBL23183135 0.69 ALDH1A1 (0.58) CA2CA1NQO2TTRTUBB4A
SCHEMBL1163205 0.69 CA2 (0.52) CA2CA4MAPTHPGDHSD17B10

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-4400172-A2 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS Incyte Holdings Corporation (US) 2024-07-17 — — EP disclosed
EP-3354652-A1 PIPERIDIN-4-YL AZETIDINE DERIVATIVES AS JAK1 INHIBITORS Incyte Holdings Corporation (US) 2018-08-01 — — EP disclosed
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