SCHEMBL11076308

SCHEMBL11076308

CC(C)=CCn1cnc(N)c2ncnc1-2

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AHCY P23526 11/20 0.57
JAK2 O60674 1/20 0.40
ADORA2A P29274 6/20 0.33
ADORA1 P30542 4/20 0.33
PI4KA P42356 2/20 0.33
PI4K2B Q8TCG2 2/20 0.33
PI4K2A Q9BTU6 2/20 0.33
PI4KB Q9UBF8 2/20 0.33
ADORA2B P29275 1/20 0.32

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
SCHEMBL170695 0.80 ADORA2A (0.41) AHCYJAK2ADORA2AADORA1PI4KA
3-Ethyladenine SCHEMBL48200 0.77 ADORA2A (0.50) AHCYADORA2AADORA1PI4KAPI4K2B
SCHEMBL9108201 0.75 ADORA2A (0.36) AHCYADORA2AADORA1PI4KAPI4K2B
3-Propyladenine SCHEMBL15756434 0.74 ADORA2A (0.53) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL27962598 0.74 ADORA2A (0.53) AHCYADORA2AADORA1PI4KAPI4K2B
SCHEMBL28115671 0.74 ADORA2A (0.56) AHCYADORA2AADORA1PI4KAPI4K2B
SCHEMBL5513295 0.74 ADORA2A (0.35) AHCYADORA2AADORA1PI4KAPI4K2B
SCHEMBL4541360 0.73 ADORA2A (0.62) AHCYADORA2AADORA1PI4KAPI4K2B
SCHEMBL1020380 0.73 AHCY (1.00) AHCYADORA2AADORA1PI4KAPI4K2B
SCHEMBL13997084 0.72 ADORA2A (0.43) AHCYADORA2AADORA1PI4KAPI4K2B

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
US-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 US disclosed
US-20210254056-A1 IDENTIFICATION AND TARGETED MODULATION OF GENE SIGNALING NETWORKS CAMP4 THERAPEUTICS CORPORATION 2021-08-19 US disclosed
US-20190192691-A1 REGULATED BIOCIRCUIT SYSTEMS OBSIDIAN THERAPEUTICS, INC. 2019-06-27 US disclosed
US-4430495-A Process for preparing lincomycin and clindamycin ribonucleotides THE UPJOHN COMPANY (US) 1984-02-07 US disclosed