SCHEMBL20070397

SCHEMBL20070397

O=S(=O)(CC1CC1)C1CCN(S)CC1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.32
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
TYK2 P29597 1/20 0.31
JAK3 P52333 1/20 0.31

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
SCHEMBL20205874 0.79 NCF1 (0.40) CTSSJAK2JAK1TYK2JAK3
SCHEMBL20147689 0.75 JAK2 (0.38) CTSSJAK2JAK1
SCHEMBL14836376 0.75 CTSS (0.32) CTSS
SCHEMBL15606535 0.73 NCF1 (0.34) CTSSJAK2JAK1JAK3
SCHEMBL20070399 0.71 HRH3 (0.34) CTSSJAK2JAK1
SCHEMBL20205875 0.70 JAK2 (0.31) CTSSJAK2JAK1
SCHEMBL14836687 0.70 GABRA1 (0.48) JAK2JAK1TYK2JAK3
SCHEMBL20147924 0.69 UBE2M (0.34) JAK2JAK1
SCHEMBL19195506 0.69 IDO1 (0.31)
SCHEMBL15604131 0.68 CTSS (0.31) CTSS

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-2018071454-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ANDREWS STEVEN W (US) 2018-04-19 WO disclosed