SCHEMBL30224760

SCHEMBL30224760

CC1(C)OB([C@H]2C[C@@H]2c2ccc3cnn(CC(F)(F)F)c3c2)OC1(C)C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 2/20 0.31
▸ HTR2C P28335 2/20 0.31
▸ IRAK4 Q9NWZ3 1/20 0.30
▸ HTR2B P41595 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
SCHEMBL30224579 0.92 HTR2A (0.31) HTR2AHTR2C
SCHEMBL30181463 0.83 NT5E (0.33) —
SCHEMBL25005003 0.83 GRIN1 (0.31) —
SCHEMBL23993425 0.83 GRIN1 (0.31) —
SCHEMBL30181579 0.83 GRIN1 (0.31) —
SCHEMBL23994136 0.83 NT5E (0.33) —
SCHEMBL30181922 0.83 NT5E (0.33) —
SCHEMBL23991654 0.82 PDE2A (0.30) —
SCHEMBL25005868 0.82 PDE2A (0.30) —
SCHEMBL23993392 0.82 CYP17A1 (0.31) —

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-4422756-A1 CD73 COMPOUNDS GILEAD SCIENCES, INC. (US) 2024-09-04 — — EP disclosed
WO-2023077030-A1 CD73 COMPOUNDS GILEAD SCIENCES, INC. (US) 2023-05-04 — — WO disclosed
EP-4143194-A1 CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 2023-03-08 — — EP disclosed
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