SCHEMBL17484165

SCHEMBL17484165

O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(N2CCc3c(cnc4ccccc34)C2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 1.00
PDGFRB P09619 12/20 1.00

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
SCHEMBL17484149 0.87 KDR (1.00) KDRPDGFRB
SCHEMBL17484152 0.85 KDR (1.00) KDRPDGFRB
SCHEMBL17484148 0.85 KDR (1.00) KDRPDGFRB
SCHEMBL15240959 0.82 KDR (0.83) KDRPDGFRB
SCHEMBL17484162 0.82 KDR (1.00) KDRPDGFRB
SCHEMBL15238491 0.80 KDR (1.00) KDRPDGFRB
SCHEMBL15238540 0.80 KDR (1.00) KDRPDGFRB
SCHEMBL15238557 0.80 KDR (1.00) KDRPDGFRB
SCHEMBL17484153 0.80 KDR (0.68) KDRPDGFRB
SCHEMBL15238601 0.78 KDR (1.00) KDRPDGFRB

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
US-9255096-B1 Substituted 1,2,3,4-tetrahydrobenzo[C][2,7] naphthyridines and derivatives thereof as kinase inhibitors ALLERGAN, INC. (US) 2016-02-09 US claimed
US-9255096-B1 Substituted 1,2,3,4-tetrahydrobenzo[C][2,7] naphthyridines and derivatives thereof as kinase inhibitors ALLERGAN, INC. (US) 2016-02-09 US disclosed