SCHEMBL23995369

SCHEMBL23995369

CCC1CCC1Nc1cc(-c2cnc(OC)nc2OC)nn2ccnc12

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 17/20 0.38
▸ ACP1 P24666 1/20 0.36
▸ PPARD Q03181 1/20 0.33
▸ MTOR P42345 1/20 0.31

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
SCHEMBL25005175 0.81 SYK (0.43) SYKACP1MTOR
SCHEMBL25004812 0.80 SYK (0.45) SYKACP1MTOR
SCHEMBL23991557 0.77 MTOR (0.38) SYKACP1PPARDMTOR
SCHEMBL30224465 0.77 MTOR (0.38) SYKACP1PPARDMTOR
SCHEMBL23992849 0.76 SYK (0.46) SYKACP1
SCHEMBL25005507 0.75 MDM2 (0.38) SYKPPARDMTOR
SCHEMBL30224642 0.75 SYK (0.36) SYKACP1PPARDMTOR
SCHEMBL23994516 0.75 SYK (0.36) SYKACP1PPARDMTOR
SCHEMBL23994425 0.74 SYK (0.38) SYKACP1PPARDMTOR
SCHEMBL30224213 0.74 SYK (0.38) SYKACP1PPARDMTOR

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
WO-2021222522-A1 CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 2021-11-04 — — WO disclosed
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