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SCHEMBL30224274

SCHEMBL30224274

CC(C)(C)Oc1ncc(-c2cc(OCC(F)(F)COc3cc(-c4cnc(OC(C)(C)C)nc4OC(C)(C)C)nn4ccnc34)c3nccn3n2)c(OC(C)(C)C)n1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 2/20 0.41
▸ ATM Q13315 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ GAA P10253 1/20 0.36
▸ HCRTR2 O43614 1/20 0.34

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
SCHEMBL25005896 1.00 NPSR1 (0.41) NPSR1ATMMEN1KMT2ASMN1; SMN2
SCHEMBL23994719 0.95 NPSR1 (0.39) NPSR1ATMMEN1KMT2ASMN1; SMN2
SCHEMBL30181620 0.94 NPSR1 (0.39) NPSR1ATMMEN1KMT2ASMN1; SMN2
SCHEMBL23994264 0.94 NPSR1 (0.39) NPSR1ATMMEN1KMT2ASMN1; SMN2
SCHEMBL30224893 0.94 NPSR1 (0.41) NPSR1ATMMEN1KMT2ASMN1; SMN2
SCHEMBL23994494 0.92 NPSR1 (0.40) NPSR1ATMMEN1KMT2ASMN1; SMN2
SCHEMBL30224427 0.92 NPSR1 (0.40) NPSR1ATMMEN1KMT2ASMN1; SMN2
SCHEMBL30224462 0.92 NPSR1 (0.42) NPSR1ATMMEN1KMT2ASMN1; SMN2
SCHEMBL23994436 0.91 NPSR1 (0.37) NPSR1ATMMEN1KMT2ASMN1; SMN2
SCHEMBL30224848 0.91 NPSR1 (0.37) NPSR1ATMMEN1KMT2ASMN1; SMN2

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-4143194-A1 CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 2023-03-08 — — EP disclosed
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