SCHEMBL27157690

SCHEMBL27157690

COc1nc(NC(=O)O)c2nc[nH]c2n1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ BRD4 O60885 5/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ GABRR1 P24046 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ADORA3 P0DMS8 3/20 0.30
▸ QPCT Q16769 1/20 0.30

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
SCHEMBL29124868 0.82 SYK (0.38) TDP1
SCHEMBL28164597 0.81 ADORA3 (0.35) LMNAALDH1A1GABRR1ADORA3
SCHEMBL13828436 0.80 XDH (0.36) —
SCHEMBL18670632 0.78 LMNA (0.33) LMNABRD4ALDH1A1GABRR1
SCHEMBL23982374 0.72 CDK1 (0.45) LMNATDP1HPGDMEN1CYP1A2
SCHEMBL29654971 0.71 BRD4 (0.40) BRD4
SCHEMBL453219 0.71 ABL1 (0.34) ALDH1A1MEN1KMT2AKDM4E
SCHEMBL22118770 0.71 BRD4 (0.40) BRD4
SCHEMBL16146526 0.71 ADORA3 (0.43) LMNAALDH1A1KDM4EADORA3
SCHEMBL18464405 0.70 TSHR (0.50) CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4329773-A1 PURINE NUCLEOSIDES, THEIR INTERMEDIATES, AND METHODS OF PREPARATION THEREOF Astrocyte Pharmaceuticals, Inc. (US) 2024-03-06 — — EP disclosed
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