SCHEMBL5229324

SCHEMBL5229324

Nc1c(CC(F)(F)F)c(Cl)nc2ncnn12

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MBOAT4 Q96T53 20/20 0.63

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
SCHEMBL5229986 0.80 MBOAT4 (0.56) MBOAT4
SCHEMBL22968411 0.78 MBOAT4 (1.00) MBOAT4
SCHEMBL22968380 0.74 MBOAT4 (0.71) MBOAT4
SCHEMBL5799693 0.74 MBOAT4 (0.51) MBOAT4
SCHEMBL5227025 0.73 MBOAT4 (0.50) MBOAT4
SCHEMBL5227918 0.73 MBOAT4 (0.40) MBOAT4
SCHEMBL21224007 0.70 MBOAT4 (1.00) MBOAT4
SCHEMBL22968266 0.70 MBOAT4 (1.00) MBOAT4
SCHEMBL5226752 0.70 MBOAT4 (0.67) MBOAT4
SCHEMBL5225240 0.68 MBOAT4 (0.44) MBOAT4

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
US-7307172-B2 7-amino triazolopyrimidines for controlling harmful fungi BASF AKTIENGESELLSCHAFT (DE) 2007-12-11 US claimed
EP-1414302-B1 7-AMINO TRIAZOLOPYRIMIDINES FOR CONTROLLING HARMFUL FUNGI BASF AG (DE) 2007-03-21 EP claimed