SCHEMBL24618587

SCHEMBL24618587

C=Cc1ccc(F)c(O[Si](C)(C)C(C)(C)C)n1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 4/20 0.31
▸ CA1 P00915 4/20 0.31
▸ CA9 Q16790 4/20 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
SCHEMBL24618591 0.77 CA12 (0.33) CA12CA1CA9
SCHEMBL29792064 0.76 VCP (0.39) CA12CA1CA9
SCHEMBL25607620 0.75 — —
SCHEMBL25171590 0.66 S1PR4 (0.32) —
SCHEMBL15912855 0.66 ALOX5AP (0.35) —
SCHEMBL21713933 0.64 BACE1 (0.30) —
SCHEMBL29990031 0.64 S1PR4 (0.30) —
SCHEMBL16987352 0.62 IRAK4 (0.34) —
SCHEMBL7712230 0.62 DRD2 (0.34) CA12CA1CA9
SCHEMBL856738 0.62 CYP2C9 (0.35) CA12CA1CA9

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-4121431-A1 DIAMINOPYRAZOLO[1,5-A]PYRIMIDINE-6-CARBONITRILE COMPOUNDS AS ADENOSINE 2A RECEPTOR AND ADENOSINE 2B RECEPTOR ANTAGONIST Bugworks Research, Inc. (US) 2023-01-25 — — EP disclosed
WO-2022149167-A1 DIAMINOPYRAZOLO[1,5-A]PYRIMIDINE-6-CARBONITRILE COMPOUNDS AS ADENOSINE 2A RECEPTOR AND ADENOSINE 2B RECEPTOR ANTAGONIST BUGWORKS RESEARCH INDIA PVT LTD (IN) 2022-07-14 — — WO disclosed
WO-2022149167-A1 DIAMINOPYRAZOLO[1,5-A]PYRIMIDINE-6-CARBONITRILE COMPOUNDS AS ADENOSINE 2A RECEPTOR AND ADENOSINE 2B RECEPTOR ANTAGONIST BUGWORKS RESEARCH INDIA PVT LTD (IN) 2022-07-14 — — WO disclosed
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