SCHEMBL9738439

SCHEMBL9738439

C=C(c1nc(C)cnc1C)C(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
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
SCHEMBL9740811 0.78 JAK3 (0.33) JAK3
SCHEMBL8012352 0.77 GRM5 (0.35) JAK3
SCHEMBL13506002 0.71 GRM5 (0.38) JAK3
SCHEMBL21316764 0.70
SCHEMBL31676354 0.70 NPC1 (0.34)
SCHEMBL30901847 0.69 SMN1; SMN2 (0.40) JAK3
SCHEMBL3504558 0.69 SMN1; SMN2 (0.40) JAK3
SCHEMBL2408636 0.69 KDM4E (0.40) JAK3
SCHEMBL28915362 0.68 DGAT1 (0.43)
SCHEMBL7702136 0.65 JAK3 (0.37) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5172706-A Smoking compositions containing an oxalate flavorant-release additive PHILIP MORRIS INCORPORATED (US) 1992-12-22 US disclosed