SCHEMBL30714935

SCHEMBL30714935

CCC1(CC)Oc2cc(Cl)c(CN3OCC(C)(C)C3=O)cc2O1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.45
MAP2K1 Q02750 1/20 0.31
P2RX7 Q99572 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
SCHEMBL30714923 0.89 BRD4 (0.47) BRD4MAP2K1
SCHEMBL11201905 0.85 BRD4 (0.47) BRD4P2RX7
SCHEMBL30715297 0.84 BRD4 (0.44) BRD4MAP2K1
SCHEMBL30715302 0.84 BRD4 (0.44) BRD4MAP2K1
SCHEMBL30715296 0.84 BRD4 (0.44) BRD4MAP2K1
SCHEMBL26696495 0.84 BRD4 (0.44) BRD4MAP2K1
SCHEMBL26696471 0.84 BRD4 (0.44) BRD4MAP2K1
SCHEMBL30715289 0.82 BRD4 (0.43) BRD4MAP2K1P2RX7
SCHEMBL26696480 0.82 BRD4 (0.43) BRD4MAP2K1P2RX7
SCHEMBL7607390 0.82 BRD4 (0.51) BRD4MAP2K1P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119403791-A Isoxazolidine derivatives as herbicidal compounds 先正达农作物保护股份公司 2025-02-07 CN disclosed
WO-2023247293-A1 ISOXALIDINE DERIVATIVES AS HERICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-12-28 WO disclosed