SCHEMBL6865597

SCHEMBL6865597

CCOc1cc(Cc2cnc(N)nc2N)cc(OS(=O)(=O)N(C)C2CC2)c1-c1cccc(N)c1

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHFR P00374 4/20 0.45

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
SCHEMBL6555410 0.91 DHFR (0.46) DHFR
SCHEMBL6866061 0.90 DHFR (0.49) DHFR
SCHEMBL6871593 0.89 DHFR (0.44) DHFR
SCHEMBL6866455 0.88 DHFR (0.48) DHFR
SCHEMBL6873186 0.88 DHFR (0.44) DHFR
SCHEMBL6871991 0.88 DHFR (0.45) DHFR
SCHEMBL6872512 0.88 DHFR (0.47) DHFR
SCHEMBL6870575 0.88 DHFR (0.48) DHFR
SCHEMBL6877887 0.87 DHFR (0.43) DHFR
SCHEMBL6870995 0.87 DHFR (0.44) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6821980-B1 Substituted 5-benzyl-2,4-diaminopyrimidines BASILEA PHARMACEUTICA AG (CH) 2004-11-23 US disclosed