SCHEMBL20040928

SCHEMBL20040928

O=C(Nc1cc(F)cc(Oc2cc(CCCC(=O)C3CC3)ncn2)c1)Nc1cc(F)cc(C(F)(F)F)c1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 20/20 0.68
▸ BRAF P15056 4/20 0.47

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
SCHEMBL16904586 0.81 KDR (1.00) KDRBRAF
SCHEMBL20041052 0.77 KDR (0.70) KDRBRAF
SCHEMBL16904584 0.76 KDR (1.00) KDRBRAF
SCHEMBL16907545 0.74 KDR (1.00) KDRBRAF
SCHEMBL20040931 0.73 KDR (0.64) KDRBRAF
SCHEMBL20040912 0.72 KDR (0.74) KDRBRAF
SCHEMBL20040937 0.72 KDR (0.76) KDRBRAF
SCHEMBL16907059 0.70 KDR (1.00) KDRBRAF
SCHEMBL18099122 0.70 KDR (0.82) KDRBRAF
SCHEMBL16904588 0.69 KDR (1.00) KDRBRAF

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
EP-2864289-B1 CYCLOPROPANECARBOXAMIDO-SUBSTITUTED AROMATIC COMPOUNDS AS ANTI-TUMOR AGENTS CB THERAPEUTICS INC (KY) 2018-04-11 — — EP disclosed
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