SCHEMBL19787499

SCHEMBL19787499

CC(C)(C)OC(=O)n1ccc2cc(/C=C\Cl)ccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.42
ABL1 P00519 2/20 0.42
EGFR P00533 2/20 0.42
HCK P08631 2/20 0.42
SRC P12931 2/20 0.42
KDR P35968 2/20 0.42
PIK3CA P42336 2/20 0.42
PIK3CB P42338 2/20 0.42
MTOR P42345 2/20 0.42
PIK3CG P48736 2/20 0.42
EPHB4 P54760 2/20 0.42
PRKDC P78527 2/20 0.42
PI4KB Q9UBF8 2/20 0.42
HDAC1 Q13547 4/20 0.40
HDAC3 O15379 3/20 0.40
HDAC4 P56524 3/20 0.40
HDAC7 Q8WUI4 3/20 0.40
HDAC2 Q92769 3/20 0.40
HDAC10 Q969S8 3/20 0.40
HDAC11 Q96DB2 3/20 0.40

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
SCHEMBL30417764 1.00 PIK3CD (0.42) PIK3CDABL1EGFRHCKSRC
SCHEMBL21457948 0.88 PIK3CD (0.43) PIK3CDABL1EGFRHCKSRC
SCHEMBL21457950 0.88 PIK3CD (0.43) PIK3CDABL1EGFRHCKSRC
SCHEMBL34460129 0.86 HDAC1 (0.45) PIK3CDABL1EGFRHCKSRC
SCHEMBL1056190 0.85 CYP2A6 (0.51) PIK3CDABL1EGFRHCKSRC
SCHEMBL14865810 0.85 PIK3CD (0.44) PIK3CDABL1EGFRHCKSRC
SCHEMBL1057492 0.85 PIK3CD (0.41) PIK3CDABL1EGFRHCKSRC
SCHEMBL30418492 0.85 PIK3CD (0.41) PIK3CDABL1EGFRHCKSRC
SCHEMBL30418960 0.85 PIK3CD (0.46) PIK3CDABL1EGFRHCKSRC
SCHEMBL1057494 0.85 PIK3CD (0.41) PIK3CDABL1EGFRHCKSRC

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
EP-3484842-B1 HALOGEN-CONTAINING METATHESIS CATALYSTS AND METHODS THEREOF MASSACHUSETTS INST TECHNOLOGY (US) 2023-05-03 EP disclosed
WO-2018013943-A1 HALOGEN-CONTAINING METATHESIS CATALYSTS AND METHODS THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2018-01-18 WO disclosed