SCHEMBL16720813

SCHEMBL16720813

Oc1ccc[c]c1-c1cccc2cn[nH]c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 3/20 0.42
▸ PLK4 O00444 1/20 0.41
▸ CHEK1 O14757 1/20 0.41
▸ AURKA O14965 1/20 0.41
▸ DAPK3 O43293 1/20 0.41
▸ MAP4K4 O95819 1/20 0.41
▸ CSF1R P07333 1/20 0.41
▸ RET P07949 1/20 0.41
▸ FGFR1 P11362 1/20 0.41
▸ PDGFRA P16234 1/20 0.41
▸ LTK P29376 1/20 0.41
▸ KDR P35968 1/20 0.41
▸ MAP2K2 P36507 1/20 0.41
▸ FLT3 P36888 1/20 0.41
▸ CSNK1A1 P48729 1/20 0.41
▸ PRKX P51817 1/20 0.41
▸ CDK5 Q00535 1/20 0.41
▸ MAP2K1 Q02750 1/20 0.41
▸ MST1R Q04912 1/20 0.41
▸ PTK2 Q05397 1/20 0.41

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
SCHEMBL16720263 0.77 METAP2 (0.50) NOS1AURKACSF1RKDRFLT3
SCHEMBL16719974 0.76 AHR (0.40) —
SCHEMBL30061113 0.75 NOS1 (0.59) NOS1PLK4CHEK1AURKADAPK3
SCHEMBL276869 0.75 NOS1 (0.59) NOS1PLK4CHEK1AURKADAPK3
SCHEMBL3064844 0.75 NOS1 (0.63) NOS1PLK4CHEK1AURKADAPK3
SCHEMBL16720815 0.73 NOS1 (0.42) NOS1PLK4CHEK1AURKADAPK3
SCHEMBL3841865 0.71 CYP1A2 (0.50) L3MBTL1SMN1; SMN2HSD17B10KDM4ECYP1A2
SCHEMBL16720362 0.70 FGFR1 (0.55) NOS1PLK4CHEK1AURKAMAP4K4
SCHEMBL16719955 0.70 GSK3B (0.53) NOS1CHEK1AURKADAPK3MAP4K4
SCHEMBL2373478 0.69 SMN1; SMN2 (0.46) CDK5L3MBTL1SMN1; SMN2HSD17B10KDM4E

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-3068758-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE The Wistar Institute Of Anatomy And Biology (US) 2016-09-21 — — EP disclosed
WO-2015073864-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE THE WISAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2015-05-21 — — WO disclosed
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