SCHEMBL8933889

SCHEMBL8933889

CC1(C)N=C(N)N=C(N)N1OCCc1ccc(Cl)cc1Cl

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHFR P00374 17/20 0.60

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
SCHEMBL8933967 0.81 DHFR (0.68) DHFR
SCHEMBL8934110 0.79 DHFR (0.55) DHFR
SCHEMBL8933937 0.79 DHFR (0.65) DHFR
SCHEMBL8934272 0.78 DHFR (0.58) DHFR
Hydrochloric Acid SCHEMBL8933962 0.78 DHFR (0.54) DHFR
SCHEMBL8933961 0.78 DHFR (0.75) DHFR
SCHEMBL9395004 0.77 DHFR (0.64) DHFR
SCHEMBL8934080 0.77 DHFR (0.64) DHFR
Bromide SCHEMBL9395252 0.76 DHFR (0.62) DHFR
SCHEMBL8934111 0.75 DHFR (0.67) 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