SCHEMBL9952845

SCHEMBL9952845

O=c1nc(Cl)[nH]c2ccc(Br)cc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
HPGD P15428 1/20 0.49
PTGES O14684 1/20 0.46
JAK2 O60674 2/20 0.46
GSK3A P49840 2/20 0.46
GSK3B P49841 2/20 0.46
CHEK1 O14757 1/20 0.46
AURKA O14965 1/20 0.46
DAPK3 O43293 1/20 0.46
PRKD3 O94806 1/20 0.46
MAP4K4 O95819 1/20 0.46
PAK4 O96013 1/20 0.46
ABL1 P00519 1/20 0.46
NTRK1 P04629 1/20 0.46
CSF1R P07333 1/20 0.46
RET P07949 1/20 0.46
MET P08581 1/20 0.46
PDGFRB P09619 1/20 0.46
PIM1 P11309 1/20 0.46
FGFR1 P11362 1/20 0.46

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
SCHEMBL30918933 0.81 LMNA (0.53) LMNAHPGDPTGESJAK2GSK3A
SCHEMBL30988528 0.81 TYMS (0.51) LMNAHPGDPTGESJAK2GSK3A
SCHEMBL6667192 0.81 LMNA (0.56) LMNAHPGDJAK2GSK3AGSK3B
SCHEMBL578429 0.79 KDM4E (0.50) LMNAHPGDCHUKMAPK1ALDH1A1
SCHEMBL5789983 0.79 TYMS (0.39) LMNAJAK2GSK3AGSK3BCHEK1
SCHEMBL3862742 0.77 LMNA (0.47) LMNAHPGDJAK2GSK3AGSK3B
SCHEMBL22101352 0.77 PRNP (0.48) LMNAHPGDJAK2GSK3AGSK3B
SCHEMBL3497007 0.76 RXFP1 (0.69) LMNAHPGDPTGESPRKD3MAP4K4
SCHEMBL1192650 0.76 NOS1 (0.41) LMNAPTGESJAK2DYRK1ACHUK
SCHEMBL6616116 0.75 RPS6KA3 (0.50) LMNAHPGDJAK2GSK3AGSK3B

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-2012087938-A1 QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-06-28 WO disclosed