SCHEMBL30410716

SCHEMBL30410716

Fc1nc(NCc2ccccc2)c2ncn(C3CCCCCO3)c2n1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.72
▸ RAB9A P51151 1/20 0.72
▸ SMN1; SMN2 Q16637 1/20 0.72
▸ CDK1 P06493 6/20 0.58
▸ CTSL P07711 2/20 0.53
▸ CDK5 Q00535 2/20 0.50
▸ YTHDC1 Q96MU7 1/20 0.50
▸ FLT3 P36888 3/20 0.49
▸ CCNE2 O96020 2/20 0.49
▸ CCNE1 P24864 2/20 0.49
▸ CDK2 P24941 2/20 0.49
▸ CCNB2 O95067 1/20 0.49
▸ CDK4 P11802 1/20 0.49
▸ CCNB1 P14635 1/20 0.49
▸ CCND1 P24385 1/20 0.49
▸ CCNB3 Q8WWL7 1/20 0.49
▸ ADORA3 P0DMS8 1/20 0.47
▸ ADORA2A P29274 1/20 0.47
▸ ADORA1 P30542 1/20 0.47
▸ CYP1A2 P05177 1/20 0.46

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
SCHEMBL30410429 0.99 NPC1 (0.73) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30410563 0.96 NPC1 (0.68) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30410406 0.93 NPC1 (0.63) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30409308 0.92 NPC1 (0.61) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30410615 0.91 NPC1 (0.62) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30409622 0.91 NPC1 (0.59) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30409314 0.90 NPC1 (0.59) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30410674 0.90 NPC1 (0.59) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30410572 0.90 NPC1 (0.59) NPC1RAB9ASMN1; SMN2CDK1CTSL
SCHEMBL30411040 0.90 NPC1 (0.59) 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 3 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 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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