SCHEMBL16758639

SCHEMBL16758639

Cc1ccc(S(=O)(=O)n2ccc3c2C(=O)[N]C=C3c2ccc3c(ncn3C)c2Oc2ccc(F)cc2F)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 16/20 0.47
▸ BRD2 P25440 3/20 0.47
▸ NPBWR1 P48145 1/20 0.35
▸ MCHR1 Q99705 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ EED O75530 1/20 0.34
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 1/20 0.33

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
SCHEMBL16738961 0.79 BRD4 (0.64) BRD4BRD2NPBWR1MCHR1
SCHEMBL16739002 0.77 BRD4 (0.64) BRD4BRD2
SCHEMBL16738999 0.75 BRD4 (0.66) BRD4BRD2
SCHEMBL16758648 0.74 BRD4 (0.50) BRD4BRD2NPBWR1MCHR1LMNA
SCHEMBL16739072 0.66 BRD4 (0.56) BRD4BRD2NPBWR1MCHR1
SCHEMBL16738899 0.65 BRD4 (0.47) BRD4BRD2
SCHEMBL16738951 0.64 BRD4 (0.85) BRD4BRD2
SCHEMBL16739055 0.64 BRD4 (1.00) BRD4BRD2
SCHEMBL16738921 0.64 BRD4 (0.48) BRD4BRD2
SCHEMBL18391561 0.64 BRD4 (0.59) BRD4BRD2

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
WO-2015081203-A1 BICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS INCYTE CORPORATION (US) 2015-06-04 — — WO disclosed
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