SCHEMBL11439399

SCHEMBL11439399

Cn1cc(-c2cccc(I)c2)c(=O)c(-c2c(F)cccc2F)c1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 4/20 0.32
▸ CCKAR P32238 2/20 0.31
▸ CCKBR P32239 2/20 0.31
▸ LIPG Q9Y5X9 1/20 0.31
▸ WEE1 P30291 1/20 0.31
▸ FAAH O00519 1/20 0.30
▸ MGLL Q99685 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
SCHEMBL11434332 0.84 BRD4 (0.40) BRD4CCKARCCKBRFAAHMGLL
SCHEMBL11557184 0.83 — —
SCHEMBL11428536 0.80 BRD9 (0.41) —
SCHEMBL11434573 0.76 BRD4 (0.40) BRD4
SCHEMBL11440224 0.72 HSD17B10 (0.41) BRD4
SCHEMBL11434388 0.71 MAOB (0.44) —
SCHEMBL11550813 0.70 BRD4 (0.41) BRD4MGLL
SCHEMBL11428401 0.69 AKR1C3 (0.42) CCKBR
SCHEMBL11431671 0.69 EGFR (0.50) —
SCHEMBL11441378 0.69 BRD4 (0.43) BRD4FAAHMGLL

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
US-4235619-A USING 3-PHENYL-4(1H)-PYRIDONES OR PYRIDINETHIONES ELI LILLY AND COMPANY (US) 1980-11-25 — — US disclosed
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