SCHEMBL3950324

SCHEMBL3950324

CC1CCCN1c1ncccc1N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 2/20 0.48
HTT P42858 3/20 0.45
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
SMARCA2 P51531 5/20 0.43
PBRM1 Q86U86 5/20 0.43
SMARCA4 P51532 4/20 0.43
NR1I2 O75469 2/20 0.43
NR1H2 P55055 1/20 0.43
SMPD3 Q9NY59 1/20 0.43
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
NPC1 O15118 1/20 0.42
LRRK2 Q5S007 2/20 0.41

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
SCHEMBL3288856 0.82 JAK3 (0.46) JAK3HTTLMNASMN1; SMN2NCOA3
SCHEMBL4866883 0.80 JAK1 (0.43) JAK3SMN1; SMN2SMARCA2PBRM1SMARCA4
SCHEMBL4865463 0.80 JAK1 (0.43) JAK3SMN1; SMN2SMARCA2PBRM1SMARCA4
SCHEMBL6220849 0.80 JAK1 (0.43) JAK3SMN1; SMN2SMARCA2PBRM1SMARCA4
SCHEMBL4865454 0.80 JAK1 (0.43) JAK3SMN1; SMN2SMARCA2PBRM1SMARCA4
SCHEMBL4865461 0.80 JAK1 (0.43) JAK3SMN1; SMN2SMARCA2PBRM1SMARCA4
SCHEMBL4866890 0.80 JAK1 (0.43) JAK3SMN1; SMN2SMARCA2PBRM1SMARCA4
SCHEMBL28715492 0.79 GFER (0.48) JAK3HTTLMNASMN1; SMN2NCOA3
SCHEMBL3291095 0.78 AR (0.52) JAK3HTTLMNASMN1; SMN2NCOA3
SCHEMBL4674143 0.75 JAK3 (0.45) JAK3HTTLMNASMN1; SMN2NCOA3

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-1413286-B1 Dyeing composition comprising at least one heterocyclic oxidation base and at least one substituted 2,3-diaminopyridine as a coupling agent OREAL (FR) 2009-04-22 EP disclosed
EP-1413286-A1 Dyeing composition comprising at least one heterocyclic oxidation base and at least one substituted 2,3-diaminopyridine as a coupling agent L'OREAL (FR) 2004-04-28 EP disclosed