SCHEMBL1968792

SCHEMBL1968792

C[C@H](NC(=O)c1cc2c(O)c3ccc(C(F)(F)F)cc3n2n(Cc2ccc(F)cc2)c1=O)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.40
EGLN2 Q96KS0 1/20 0.40
EGLN3 Q9H6Z9 1/20 0.40
PTGER4 P35408 4/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
HDAC6 Q9UBN7 2/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
HDAC11 Q96DB2 1/20 0.37
PPARG P37231 5/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CNR1 P21554 2/20 0.35
CNR2 P34972 2/20 0.35
P2RX3 P56373 1/20 0.35

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
SCHEMBL1967018 0.88 L3MBTL1 (0.44) EGLN1KDM4EALDH1A1CNR1CNR2
SCHEMBL1969288 0.86 EGLN1 (0.53) EGLN1EGLN2EGLN3HDAC1HDAC8
SCHEMBL1963992 0.85 KDM4E (0.45) EGLN1EGLN2EGLN3HDAC1HDAC8
SCHEMBL3732846 0.83 EGLN1 (0.38) EGLN1EGLN2EGLN3PTGER4HDAC1
SCHEMBL3732845 0.83 EGLN1 (0.38) EGLN1EGLN2EGLN3PTGER4HDAC1
SCHEMBL1966135 0.73 L3MBTL1 (0.44) EGLN1KDM4EALDH1A1CNR1CNR2
SCHEMBL1966134 0.73 L3MBTL1 (0.44) EGLN1KDM4EALDH1A1CNR1CNR2
SCHEMBL1965654 0.72 EGLN1 (0.51) EGLN1EGLN2EGLN3
SCHEMBL1968417 0.71 EGLN3 (0.44) EGLN1EGLN2EGLN3HDAC1HDAC8
SCHEMBL2384067 0.70 L3MBTL1 (0.52) EGLN1EGLN2EGLN3KDM4EALDH1A1

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 4 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 claimed
WO-2010022240-A1 PYRROLO [ 1, 2 -B] PYRIDAZINE DERIVATIVES AND THEIR USE AS HIF MODULATORS FIBROGEN, INC. (US) 2010-02-25 WO claimed
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