SCHEMBL5453330

SCHEMBL5453330

Nc1ccc(OC2(Oc3ccc(N)c(C(F)(F)F)c3)C=CC(c3ccccc3)C=C2)cc1C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.35
TNK2 Q07912 1/20 0.32
ACHE P22303 1/20 0.31
AR P10275 1/20 0.30

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
SCHEMBL713922 0.80 GAA (0.33)
SCHEMBL8834875 0.77 GAA (0.41)
SCHEMBL8741834 0.77 TACR1 (0.36)
SCHEMBL1119475 0.76 MAOA (0.41)
SCHEMBL1270081 0.75 MAOB (0.46)
SCHEMBL1119437 0.74 MAOB (0.41) TNK2
SCHEMBL10664109 0.70 MAOB (0.48) FFAR4TNK2AR
SCHEMBL30287666 0.70 MAOB (0.48) FFAR4TNK2AR
SCHEMBL8741878 0.69 MAOB (0.30)
Ammonia Solution, Strong SCHEMBL8741833 0.68

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
US-20070031087-A1 Optical waveguide structure HITACHI CHEMICAL COMPANY, LTD. (JP) 2007-02-08 US disclosed