SCHEMBL20125403

SCHEMBL20125403

C=CC(=O)N1CCCC(Nc2ncnc3[nH]cc(CCC#N)c23)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 20/20 1.00

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
SCHEMBL16765153 1.00 JAK3 (1.00) JAK3
SCHEMBL16765264 0.91 JAK3 (1.00) JAK3
SCHEMBL16765262 0.91 JAK3 (1.00) JAK3
SCHEMBL16765459 0.90 JAK3 (0.82) JAK3
SCHEMBL16764910 0.90 JAK3 (0.83) JAK3
SCHEMBL16764911 0.90 JAK3 (0.83) JAK3
SCHEMBL16766003 0.89 JAK3 (1.00) JAK3
SCHEMBL16766005 0.89 JAK3 (1.00) JAK3
SCHEMBL16764802 0.87 JAK3 (1.00) JAK3
SCHEMBL16764800 0.87 JAK3 (1.00) JAK3

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-3318565-B1 PYRROLO[2,3-D]PYRIMIDINYL, PYRROLO[2,3-B]PYRAZINYL AND PYRROLO[2,3-D]PYRIDINYL ACRYLAMIDES PFIZER (US) 2021-04-14 EP disclosed
EP-3318565-A1 PYRROLO[2,3-D]PYRIMIDINYL, PYRROLO[2,3-B]PYRAZINYL AND PYRROLO[2,3-D]PYRIDINYL ACRYLAMIDES Pfizer Inc (US) 2018-05-09 EP disclosed