SCHEMBL19520171

SCHEMBL19520171

Cc1nc(N)c2ncccc2n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.56
LIMK1 P53667 1/20 0.47
LMNA P02545 2/20 0.47
NOS3 P29474 1/20 0.45
NOS1 P29475 1/20 0.45
NOS2 P35228 1/20 0.45
ADORA1 P30542 4/20 0.45
ADORA2A P29274 2/20 0.45
ADORA2B P29275 1/20 0.45
HRH4 Q9H3N8 1/20 0.42
TLR8 Q9NR97 2/20 0.41
TLR7 Q9NYK1 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HSP90AA1 P07900 2/20 0.41
NPC1 O15118 1/20 0.41
CCR1 P32246 2/20 0.41
CCR5 P51681 2/20 0.41
CCR8 P51685 2/20 0.41
DHFR P00374 1/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL29671993 1.00 PRMT5 (0.56) PRMT5LIMK1LMNANOS3NOS1
SCHEMBL19169687 0.80 PRMT5 (0.50) PRMT5LMNAHRH4L3MBTL1HSP90AA1
SCHEMBL3617192 0.80 DHFR (0.54) PRMT5LMNAADORA2AHRH4TLR8
SCHEMBL29517215 0.80 DHFR (0.54) PRMT5LMNAADORA2AHRH4TLR8
SCHEMBL24953761 0.77 PRMT5 (0.47) PRMT5LMNAL3MBTL1HSP90AA1NPC1
SCHEMBL16466554 0.77 PRMT5 (0.47) PRMT5LMNAHRH4TLR8TLR7
SCHEMBL25746299 0.77 PRMT5 (0.47) PRMT5LMNAHRH4L3MBTL1HSP90AA1
SCHEMBL19661008 0.77 PRMT5 (0.47) PRMT5LMNAHRH4L3MBTL1HSP90AA1
SCHEMBL31353938 0.77 PRMT5 (0.47) PRMT5LMNAL3MBTL1HSP90AA1NPC1
SCHEMBL8207691 0.77 PRMT5 (0.47) PRMT5LMNANOS3NOS1NOS2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4467199-A2 SMALL MOLECULE INHIBITORS OF NF-KB INDUCING KINASE JANSSEN Pharmaceutica NV (BE) 2024-11-27 EP disclosed
EP-3976597-B1 SMALL MOLECULE INHIBITORS OF NF-KB INDUCING KINASE JANSSEN PHARMACEUTICA NV (BE) 2024-08-28 EP disclosed
EP-3722297-A1 TOLL-LIKE RECEPTOR MODULATING 4,6-DIAMINO-PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS Gilead Sciences, Inc. (US) 2020-10-14 EP disclosed
EP-3097102-B1 TOLL-LIKE RECEPTOR MODULATING 4,6-DIAMINO-PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS GILEAD SCIENCES INC (US) 2017-10-18 EP disclosed