SCHEMBL1967018

SCHEMBL1967018

C[C@H](NC(=O)c1cc2c(O)c3ccccc3n2n(Cc2ccc(F)cc2)c1=O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
EGLN1 Q9GZT9 5/20 0.40
CNR1 P21554 4/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.39
POLB P06746 1/20 0.39
CNR2 P34972 3/20 0.38
TP53 P04637 2/20 0.38
BBOX1 O75936 2/20 0.38
FTO Q9C0B1 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
SCHEMBL1968792 0.88 EGLN1 (0.40) EGLN1CNR1KDM4EALDH1A1CNR2
SCHEMBL1965654 0.84 EGLN1 (0.51) L3MBTL1MEN1KMT2AEGLN1TP53
SCHEMBL1964132 0.82 KMT2A (0.45) L3MBTL1MEN1KMT2AKDM4EALDH1A1
SCHEMBL1966135 0.81 L3MBTL1 (0.44) L3MBTL1MEN1KMT2AEGLN1CNR1
SCHEMBL1966134 0.81 L3MBTL1 (0.44) L3MBTL1MEN1KMT2AEGLN1CNR1
SCHEMBL1967789 0.76 EGLN1 (0.44) L3MBTL1MEN1KMT2AEGLN1
SCHEMBL1968417 0.75 EGLN3 (0.44) EGLN1
SCHEMBL1967638 0.74 MEN1 (0.41) L3MBTL1MEN1KMT2AKDM4EALDH1A1
SCHEMBL3732845 0.73 EGLN1 (0.38) L3MBTL1EGLN1KDM4EALDH1A1CNR2
SCHEMBL3732846 0.73 EGLN1 (0.38) L3MBTL1EGLN1KDM4EALDH1A1CNR2

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