SCHEMBL9525617

SCHEMBL9525617

Cc1cc(=O)c(O)nn1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.71
NPY5R Q15761 15/20 0.55
KMT2A Q03164 3/20 0.53
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
MAPK1 P28482 1/20 0.48

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
SCHEMBL9594529 0.84 POLB (0.67) POLBNPY5RKMT2A
SCHEMBL9592489 0.84 POLB (0.67) POLBNPY5RKMT2AMEN1MAPT
SCHEMBL9184563 0.83 POLB (1.00) POLBNPY5RKMT2AMAPK1
SCHEMBL9879206 0.82 POLB (0.80) POLBNPY5RKMT2AMAPK1
SCHEMBL9870858 0.82 POLB (0.65) POLBNPY5RKMT2A
SCHEMBL9593791 0.82 POLB (0.65) POLBNPY5RKMT2A
SCHEMBL9869664 0.82 POLB (0.65) POLBNPY5RKMT2AMEN1MAPT
SCHEMBL21904916 0.81 POLB (0.71) POLBNPY5RKMT2A
SCHEMBL9592706 0.81 POLB (0.67) POLBNPY5RKMT2A
SCHEMBL13523080 0.80 POLB (0.61) POLBNPY5RKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5286945-A None JP disclosed
JP-H05286945-A DERIVATIVE OF 1-PHENYL-1,4-DIHYDRO-3-HYDROXY-4-OXOPYRIDAZINE, ITS PREPARATION AND ITS APPLICATION FOR THERAPY PIERRE FABRE MEDICAMENT 1993-11-02 JP disclosed
US-5254554-A Anxiolytic agents PIERRE FABRE MEDICAMENT (FR) 1993-10-19 US disclosed