SCHEMBL11375341

SCHEMBL11375341

O=C(CO)c1cccc(Oc2ccc(Cl)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 1/20 0.54
FEN1 P39748 1/20 0.54
AKR1C3 P42330 1/20 0.51
PARP14 Q460N5 2/20 0.51
PARP10 Q53GL7 2/20 0.51
TNKS O95271 1/20 0.51
PARP15 Q460N3 1/20 0.51
TNKS2 Q9H2K2 1/20 0.51
PARP2 Q9UGN5 1/20 0.51
KMO O15229 1/20 0.51
PPARG P37231 2/20 0.48
PPARA Q07869 1/20 0.48
MRGPRX4 Q96LA9 2/20 0.48
NR4A2 P43354 1/20 0.48
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
HDAC8 Q9BY41 1/20 0.46
MMP1 P03956 1/20 0.46
POLB P06746 2/20 0.45
MEN1 O00255 1/20 0.45

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
SCHEMBL11110885 0.87 ERCC5 (0.69) ERCC5FEN1AKR1C3PARP14PARP10
SCHEMBL11110229 0.83 MMP1 (0.61) ERCC5FEN1PARP14PARP10PARP15
SCHEMBL31590697 0.82 AKR1C3 (0.77) AKR1C3PARP14PARP10TNKSPARP15
SCHEMBL8783043 0.82 AKR1C3 (0.77) AKR1C3PARP14PARP10TNKSPARP15
SCHEMBL6518277 0.81 PARP14 (0.58) AKR1C3PARP14PARP10TNKSPARP15
SCHEMBL11840624 0.81 MAOB (0.64) AKR1C3PARP14PARP10TNKSPARP15
SCHEMBL27916079 0.81 NR4A2 (0.74) MRGPRX4NR4A2MAOAMAOBMEN1
SCHEMBL883109 0.78 TNKS (0.58) ERCC5FEN1AKR1C3PARP14PARP10
SCHEMBL14191212 0.77 SRD5A2 (0.58) AKR1C3PARP14PARP10TNKSPARP15
SCHEMBL13250810 0.77 SRD5A2 (0.58) AKR1C3PARP14PARP10TNKSPARP15

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-4281012-A HYPOLIPEMIC ACTIVITY ROUSSEL UCLAF (FR) 1981-07-28 US disclosed