SCHEMBL23770459

SCHEMBL23770459

Cc1c(F)cccc1-c1nc(NSc2cccc(N3CCCC(C)(C(=O)O)C3)n2)ccc1C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BTK Q06187 2/20 0.34
EIF2AK4 Q9P2K8 1/20 0.33
RORC P51449 1/20 0.32
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 1/20 0.30
KIF18A Q8NI77 1/20 0.30

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
SCHEMBL23770875 0.89 BTK (0.34) BTKEIF2AK4RORCHCRTR1HCRTR2
SCHEMBL19970083 0.89 BTK (0.34) BTKEIF2AK4RORCHCRTR1HCRTR2
SCHEMBL23770463 0.88 BTK (0.34) BTKEIF2AK4HCRTR1HCRTR2
SCHEMBL19970208 0.88 BTK (0.34) BTKEIF2AK4KIF18A
SCHEMBL19970137 0.88 BTK (0.34) BTKEIF2AK4KIF18A
SCHEMBL19970089 0.88 BTK (0.36) BTKEIF2AK4KIF18A
SCHEMBL23770792 0.87 EPHX2 (0.34) BTKEIF2AK4RORCKIF18A
SCHEMBL19970020 0.87 RBP4 (0.35) BTKEIF2AK4
SCHEMBL19970081 0.87 BTK (0.33) BTKEIF2AK4
SCHEMBL19970127 0.87 BTK (0.33) BTKEIF2AK4

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-3504194-B1 N-(PYRIDIN-2-YL)PYRIDINE-SULFONAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2021-08-18 EP disclosed