SCHEMBL8932265

SCHEMBL8932265

COc1cnnc(Oc2cc(C=O)nn2C)c1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL8932259 0.79 PTGS1 (0.32)
SCHEMBL8932234 0.76 KMT2A (0.49) ALDH1A1
SCHEMBL479043 0.75 PDE4B (0.36) ALDH1A1
SCHEMBL8932271 0.74 KMT2A (0.39)
SCHEMBL8932257 0.71 SMN1; SMN2 (0.34) ALDH1A1
SCHEMBL8932343 0.68
SCHEMBL8932244 0.68 KMT2A (0.48) ALDH1A1
SCHEMBL8932318 0.67 PKM (0.43) ALDH1A1
SCHEMBL9079969 0.66 ALDH1A1 (0.31) ALDH1A1
SCHEMBL21607979 0.64 LMNA (0.35) ALDH1A1

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-5536701-A 3-pyrazolyloxypyridazines, herbicidal compositions and uses thereof MONSANTO COMPANY (US) 1996-07-16 US disclosed