SCHEMBL1968417

SCHEMBL1968417

O=C(O)CNC(=O)c1cc2c(O)c3cc(F)ccc3n2n(Cc2ccc(F)cc2)c1=O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGLN3 Q9H6Z9 3/20 0.44
HIF1A Q16665 7/20 0.43
EGLN1 Q9GZT9 8/20 0.40
EGLN2 Q96KS0 1/20 0.40
AKR1B1 P15121 1/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL1965654 0.91 EGLN1 (0.51) EGLN3HIF1AEGLN1EGLN2
SCHEMBL1969288 0.85 EGLN1 (0.53) EGLN3HIF1AEGLN1EGLN2HDAC1
SCHEMBL1965300 0.82 P2RX7 (0.42) HDAC1HDAC8HDAC6
SCHEMBL3731074 0.80 EGLN3 (0.51) EGLN3HIF1AEGLN1EGLN2
SCHEMBL1967789 0.78 EGLN1 (0.44) EGLN3HIF1AEGLN1EGLN2
SCHEMBL3727894 0.75 EGLN1 (0.53) EGLN3HIF1AEGLN1EGLN2
SCHEMBL1967018 0.75 L3MBTL1 (0.44) EGLN1
SCHEMBL1967854 0.75 EGLN3 (0.52) EGLN3HIF1AEGLN1EGLN2
SCHEMBL1964132 0.73 KMT2A (0.45)
SCHEMBL8248114 0.72 EGLN1 (0.76) EGLN3HIF1AEGLN1EGLN2

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
EP-2334682-A1 PYRROLO [ 1, 2 -B] PYRIDAZINE DERIVATIVES AND THEIR USE AS HIF MODULATORS Fibrogen, Inc. (US) 2011-06-22 EP disclosed
WO-2010022240-A1 PYRROLO [ 1, 2 -B] PYRIDAZINE DERIVATIVES AND THEIR USE AS HIF MODULATORS FIBROGEN, INC. (US) 2010-02-25 WO disclosed