SCHEMBL3253663

SCHEMBL3253663

Cc1c[nH]c(-c2cc(CC(=O)Nc3ccc(Oc4ncnc5[nH]cnc45)cc3)cc(C(F)(F)F)c2)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 3/20 0.45
▸ PSEN2 P49810 3/20 0.45
▸ APH1B Q8WW43 3/20 0.45
▸ NCSTN Q92542 3/20 0.45
▸ APH1A Q96BI3 3/20 0.45
▸ PSENEN Q9NZ42 3/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CSF1R P07333 5/20 0.42
▸ PDGFRB P09619 3/20 0.42
▸ PDGFRA P16234 2/20 0.42
▸ FLT3 P36888 5/20 0.40
▸ KDR P35968 6/20 0.39
▸ BRAF P15056 3/20 0.39
▸ MAPK14 Q16539 2/20 0.39
▸ TNNI3K Q59H18 2/20 0.39
▸ TEK Q02763 1/20 0.39
▸ CDK8 P49336 1/20 0.37
▸ FLT4 P35916 1/20 0.37
▸ KIT P10721 1/20 0.37
▸ RIPK1 Q13546 1/20 0.36

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
SCHEMBL4715500 0.88 FLT3 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2843359 0.82 NR2E1 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3256674 0.75 KDR (0.57) CSF1RFLT3KDRBRAFMAPK14
SCHEMBL3247880 0.75 KDR (0.66) CSF1RPDGFRBPDGFRAFLT3KDR
SCHEMBL2850437 0.71 KDR (0.73) CSF1RFLT3KDRBRAFMAPK14
SCHEMBL2840607 0.70 KDR (0.56) FLT3KDRBRAFMAPK14TNNI3K
SCHEMBL2845926 0.70 KDR (0.56) FLT3KDRBRAFMAPK14TNNI3K
SCHEMBL12975650 0.70 NR2E1 (0.55) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2847973 0.68 KDR (0.74) CSF1RPDGFRBPDGFRAFLT3KDR
SCHEMBL25403334 0.67 KDR (0.65) CSF1RPDGFRBPDGFRAFLT3KDR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010056907-A2 COMPOUNDS THAT INDUCE PANCREATIC BETA-CELL EXPANSION THE SCRIPPS RESEARCH INSTITUTE (US) 2010-05-20 — — WO claimed
EP-1940844-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2008-07-09 — — EP claimed
WO-2007053343-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2007-05-10 — — WO claimed
EP-1940844-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2008-07-09 — — EP disclosed
WO-2007053343-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2007-05-10 — — WO disclosed
Send feedback