SCHEMBL19129082

SCHEMBL19129082

CC(C)C(=O)N1CCCC12CN(CC(=O)NC(c1ncno1)C(C)C)C2=O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 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
SCHEMBL15937172 0.95 JAK3 (0.33) JAK3
SCHEMBL17359172 0.95 JAK3 (0.33) JAK3
SCHEMBL17359164 0.92
SCHEMBL15937215 0.86 GRIN2B (0.32)
SCHEMBL15937177 0.86 GRIN2B (0.32)
SCHEMBL17359167 0.86
SCHEMBL19129085 0.84 JAK3 (0.33) JAK3
SCHEMBL17351832 0.82 GRIN2B (0.47) JAK3
SCHEMBL17359171 0.82 GRIN2B (0.47) JAK3
SCHEMBL15937153 0.81

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
US-9708335-B2 Spiro-lactam NMDA receptor modulators and uses thereof Apytinyx Inc. (US) 2017-07-18 US disclosed