SCHEMBL8070274

SCHEMBL8070274

COc1cc2nc(N3CCC(Nc4ccc(C(=O)OC(C)(C)C)cc4)CC3)nc(Nc3ccc(C)cc3)c2cc1OC

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 9/20 0.52
EHMT2 Q96KQ7 7/20 0.52
WHR1 P49842 3/20 0.50
EHMT1 Q9H9B1 4/20 0.49
KMT5A Q9NQR1 1/20 0.48

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
SCHEMBL8070283 0.89 CCR4 (0.56) CCR4EHMT2WHR1EHMT1
SCHEMBL8061075 0.87 EHMT2 (0.48) EHMT2WHR1EHMT1KMT5A
SCHEMBL8076826 0.86 ADRA1A (0.56)
SCHEMBL8071618 0.81 DNMT1 (0.45) EHMT2WHR1EHMT1KMT5A
SCHEMBL8071876 0.79 MGLL (0.46) EHMT2KMT5A
SCHEMBL8077026 0.78 ADRA1A (0.60)
SCHEMBL8070244 0.75 EHMT2 (0.52) EHMT2WHR1EHMT1
SCHEMBL8071911 0.74 ADRA1A (0.62)
SCHEMBL29613548 0.74 NSD2 (0.70) CCR4EHMT2EHMT1KMT5A
SCHEMBL27223024 0.74 NSD2 (0.70) CCR4EHMT2EHMT1KMT5A

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-6156758-A Antibacterial quinazoline compounds ISIS PHARMACEUTICALS, INC. (US) 2000-12-05 US disclosed