SCHEMBL8620586

SCHEMBL8620586

CCCCC(=NOC)C(=O)Oc1ccccc1COc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.42
HIF1A Q16665 5/20 0.42
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 2/20 0.39
RECQL P46063 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
POLB P06746 1/20 0.39
ATM Q13315 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.36
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
PPARD Q03181 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
SCHEMBL8619527 0.88 HIF1A (0.45) FFAR1HIF1AMEN1KMT2AKDM4E
SCHEMBL8623899 0.88 TDP1 (0.39) MEN1KMT2AKDM4ERECQLPOLB
SCHEMBL8620524 0.86 HIF1A (0.48) HIF1AL3MBTL1
SCHEMBL8623949 0.83 PTGDR2 (0.41) MEN1KMT2AKDM4EL3MBTL1POLB
SCHEMBL8618263 0.81 ANO1 (0.46) FFAR1HIF1AMEN1KMT2AKDM4E
SCHEMBL8623908 0.81 HIF1A (0.46) FFAR1HIF1AMEN1KMT2AKDM4E
SCHEMBL8622048 0.75 TDP1 (0.41) KMT2ARECQLL3MBTL1POLB
SCHEMBL8620517 0.75 HIF1A (0.51) HIF1AKDM4EL3MBTL1
SCHEMBL8621428 0.73 MAPT (0.45) FFAR1HIF1AMEN1KMT2AL3MBTL1
SCHEMBL27458124 0.72 TDP1 (0.46) KDM4EL3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0658541-B1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO (JP) 1998-05-20 EP disclosed
US-5510506-A Process for producing carboxylic acid derivatives SHIONOGI & CO., LTD. (JP) 1996-04-23 US disclosed
EP-0658541-A1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO., LTD. (JP) 1995-06-21 EP disclosed