SCHEMBL8934110

SCHEMBL8934110

CC(CON1C(N)=NC(N)=NC1(C)C)c1ccc(Cl)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DHFR P00374 17/20 0.55
SLC2A1 P11166 1/20 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
Hydrochloric Acid SCHEMBL8933962 0.99 DHFR (0.54) DHFRSLC2A1
SCHEMBL8934083 0.82 DHFR (0.49) DHFR
SCHEMBL8934277 0.80 DHFR (0.60) DHFRSLC2A1
SCHEMBL8934343 0.79 DHFR (0.53) DHFRSLC2A1
SCHEMBL8933889 0.79 DHFR (0.60) DHFR
SCHEMBL8934095 0.75 DHFR (0.49) DHFR
SCHEMBL9395449 0.72 DHFR (0.53) DHFRSLC2A1
SCHEMBL9395494 0.71 DHFR (0.53) DHFRSLC2A1
Hydrochloric Acid SCHEMBL9395431 0.71 DHFR (0.53) DHFRSLC2A1
SCHEMBL8933961 0.71 DHFR (0.75) DHFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996015671-A1 HERBICIDES ZENECA LIMITED (GB) 1996-05-30 WO claimed
WO-1996015671-A1 HERBICIDES ZENECA LIMITED (GB) 1996-05-30 WO disclosed