SCHEMBL9115709

SCHEMBL9115709

Cc1c(Cl)ccc(C(=O)c2cnoc2C2CC2)c1OCC(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 2/20 0.38
CNR2 P34972 11/20 0.37
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CRHR1 P34998 3/20 0.35
PDE2A O00408 1/20 0.35
HCRTR2 O43614 1/20 0.35
EPHX2 P34913 1/20 0.35

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
SCHEMBL9115702 0.87 DHODH (0.36) DHODHCNR2MEN1KMT2ACRHR1
SCHEMBL9114754 0.85 DHODH (0.35) DHODHCNR2MEN1KMT2APDE2A
SCHEMBL9115261 0.85 DHODH (0.36) DHODHCNR2MEN1KMT2A
SCHEMBL8886577 0.84 DHODH (0.35) DHODHCNR2MEN1KMT2A
SCHEMBL9116248 0.80 ALDH1A1 (0.44) DHODHCNR2MEN1KMT2AEPHX2
SCHEMBL9115170 0.80 ALDH1A1 (0.42) DHODHCNR2
SCHEMBL9115201 0.78 DHODH (0.38) DHODHMEN1KMT2ACRHR1PDE2A
SCHEMBL9116932 0.77 DHODH (0.35) DHODHMEN1KMT2APDE2A
SCHEMBL9116275 0.77 DHODH (0.33) DHODHCNR2MEN1KMT2AEPHX2
SCHEMBL9115598 0.77 DHODH (0.35) DHODHCNR2HCRTR2EPHX2

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
WO-1995022903-A1 NEW PESTICIDAL METHOD RHONE-POULENC AGROCHIMIE (FR) 1995-08-31 WO disclosed