SCHEMBL3946038

SCHEMBL3946038

COCC(N)c1ncc(F)cn1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
APLNR P35414 4/20 0.33
HDAC6 Q9UBN7 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
Hydrochloric Acid SCHEMBL3946077 0.98 APLNR (0.33) APLNR
SCHEMBL22169703 0.78 GRIN2D (0.32)
SCHEMBL3937906 0.77 APLNR (0.31) APLNRHDAC6
SCHEMBL1693712 0.77 APLNR (0.42) APLNRHDAC6
Hydrochloric Acid SCHEMBL28446832 0.76 LMNA (0.32)
Hydrochloric Acid SCHEMBL30396919 0.76 LMNA (0.32)
Hydrochloric Acid SCHEMBL3938088 0.75 APLNR (0.41) APLNRHDAC6
SCHEMBL2161139 0.75 SYK (0.31)
SCHEMBL2161155 0.75 SYK (0.31)
SCHEMBL1395919 0.75 SYK (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
WO-2009095712-A2 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2009-08-06 WO disclosed
WO-2009016410-A2 CHEMICAL COMPOUNDS 831 ASTRAZENECA AB (SE) 2009-02-05 WO disclosed
WO-2008132502-A1 PYRAZOLYL-AMINO-SUBSTITUTED PYRIMIDINES AND THEIR USE FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2008-11-06 WO disclosed