SCHEMBL30410406

SCHEMBL30410406

Fc1nc(NCc2ccccc2)c2ncn(C3CCO3)c2n1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.63
▸ RAB9A P51151 1/20 0.63
▸ SMN1; SMN2 Q16637 1/20 0.63
▸ CDK1 P06493 8/20 0.56
▸ CTSL P07711 2/20 0.53
▸ ADORA3 P0DMS8 4/20 0.51
▸ ADORA2A P29274 2/20 0.51
▸ ADORA1 P30542 2/20 0.51
▸ CCNB2 O95067 1/20 0.48
▸ CCNE2 O96020 1/20 0.48
▸ CDK4 P11802 1/20 0.48
▸ CCNB1 P14635 1/20 0.48
▸ CCND1 P24385 1/20 0.48
▸ CCNE1 P24864 1/20 0.48
▸ CDK2 P24941 1/20 0.48
▸ FLT3 P36888 1/20 0.48
▸ CCNB3 Q8WWL7 1/20 0.48
▸ CDK5 Q00535 2/20 0.48
▸ ADORA2B P29275 1/20 0.45

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
SCHEMBL30410563 0.95 NPC1 (0.68) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30410429 0.94 NPC1 (0.73) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30410716 0.93 NPC1 (0.72) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30411079 0.91 NPC1 (0.53) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30410979 0.90 ADORA3 (0.58) NPC1RAB9ASMN1; SMN2ADORA3ADORA2A
SCHEMBL30410990 0.89 NPC1 (0.51) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30410654 0.89 CTSL (0.54) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30410752 0.89 ADORA3 (0.52) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30411049 0.89 NPC1 (0.51) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30410705 0.89 NPC1 (0.51) NPC1RAB9ASMN1; SMN2CDK1CTSL

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-4178959-B1 NITROGEN HETEROCYCLIC CYTOKININ DERIVATIVES, COMPOSITIONS CONTAINING THESE DERIVATIVES AND USE THEREOF UNIV PALACKEHO (CZ) 2025-09-10 — — EP claimed
EP-4178959-A1 NITROGEN HETEROCYCLIC CYTOKININ DERIVATIVES, COMPOSITIONS CONTAINING THESE DERIVATIVES AND USE THEREOF Univerzita Palackého v Olomouci (CZ) 2023-05-17 — — EP disclosed
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