SCHEMBL1033035

SCHEMBL1033035

O=C(NCCO)Oc1nc(Cl)c2ccccc2c1O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 6/20 0.47
FTO Q9C0B1 4/20 0.47
BBOX1 O75936 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 1/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
KMT2A Q03164 1/20 0.39
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
TAAR1 Q96RJ0 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36

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
SCHEMBL1033539 0.88 EGLN1 (0.46) EGLN1FTOBBOX1THRATHRB
SCHEMBL1028658 0.88 EGLN1 (0.46) EGLN1FTOBBOX1KDM4EALDH1A1
SCHEMBL1028622 0.86 EGLN1 (0.47) EGLN1FTOBBOX1SMN1; SMN2KDM4E
SCHEMBL1032271 0.85 FTO (0.43) EGLN1FTOBBOX1MEN1KMT2A
SCHEMBL4070933 0.82 SMN1; SMN2 (0.43) EGLN1SMN1; SMN2THRATHRB
SCHEMBL4074699 0.82 SMN1; SMN2 (0.43) EGLN1SMN1; SMN2THRATHRB
SCHEMBL1033387 0.81 FTO (0.46) EGLN1FTOBBOX1MEN1KMT2A
SCHEMBL1030683 0.81 SMN1; SMN2 (0.47) EGLN1FTOBBOX1SMN1; SMN2THRA
SCHEMBL1033120 0.81 SMN1; SMN2 (0.47) EGLN1SMN1; SMN2THRATHRBALDH1A1
SCHEMBL4080190 0.79 BCHE (0.43) EGLN1SMN1; SMN2THRATHRB

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
EP-1644336-B1 NITROGEN-CONTAINING HETEROARYL COMPOUNDS AND THEIR USE IN INCREASING ENDOGENEOUS ERYTHROPOIETIN FIBROGEN INC (US) 2011-01-19 EP claimed