SCHEMBL9027404

SCHEMBL9027404

OC(c1ccccc1CC(F)(F)F)c1c(C(F)(F)F)ccnc1Cl

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.31
F2RL1 P55085 2/20 0.31
NR3C2 P08235 1/20 0.31
CNR2 P34972 1/20 0.30
FAAH O00519 2/20 0.30
KMO O15229 1/20 0.30
CTNNB1 P35222 1/20 0.30
WNT3A P56704 1/20 0.30
PPARG P37231 1/20 0.30
PPARA Q07869 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
SCHEMBL8548569 0.85 ACP3 (0.36) P2RX7CNR2KMOCTNNB1WNT3A
SCHEMBL8324406 0.80 KMO (0.33) KMO
SCHEMBL4595530 0.71 ULK1 (0.34) P2RX7CTNNB1WNT3A
SCHEMBL8328817 0.70
SCHEMBL6152914 0.70 PDE2A (0.36) P2RX7KMO
SCHEMBL8548980 0.68 ACP3 (0.38) P2RX7CNR2CTNNB1WNT3A
SCHEMBL8908027 0.64 PDE2A (0.42)
SCHEMBL21201602 0.62 GABRA1 (0.40) P2RX7FAAH
SCHEMBL7043427 0.62 RECQL (0.36) P2RX7KMO
SCHEMBL364870 0.61 P2RX7 (0.36) P2RX7KMO

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-0695292-A1 HERBICIDAL (4-SUBSTITUTED PYRIDYL)-3-CARBINOLS ZENECA LIMITED (GB) 1996-02-07 EP disclosed