SCHEMBL8664803

SCHEMBL8664803

COC=C(C(=O)OCON=C(C)c1noc2cc(OCC3CC3(Cl)Cl)ccc12)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
NR1H4 Q96RI1 2/20 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
SCHEMBL8666037 0.86 HIF1A (0.36) ALDH1A1
SCHEMBL9057530 0.83 NR1H4 (0.37) NR1H4
SCHEMBL8668620 0.81 LMNA (0.40) ALDH1A1
SCHEMBL8665232 0.80 SMN1; SMN2 (0.39) ALDH1A1
SCHEMBL9055694 0.68 NR1H4 (0.37) ALDH1A1NR1H4
SCHEMBL9056334 0.67 HIF1A (0.37) ALDH1A1NR1H4
SCHEMBL9055635 0.67 NR1H4 (0.36) ALDH1A1NR1H4
SCHEMBL9055642 0.67 NR1H4 (0.36) ALDH1A1NR1H4
SCHEMBL8772695 0.65 MAOB (0.39) NR1H4
SCHEMBL9057229 0.65 HIF1A (0.44)

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-5786374-A FUNGICIDES, MICROBIOCIDES NOVARTIS CORPORATION (US) 1998-07-28 US claimed