SCHEMBL8624068

SCHEMBL8624068

CNC(=O)/C(=N/OC)c1ccccc1COc1cc(C)ccc1Cl

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.48
TP53 P04637 1/20 0.44
HTT P42858 1/20 0.44
MRGPRX4 Q96LA9 2/20 0.43
HDAC8 Q9BY41 1/20 0.42
KDM4E B2RXH2 2/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
ATM Q13315 1/20 0.40
CLCN2 P51788 1/20 0.39

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
SCHEMBL8624069 1.00 HIF1A (0.48) HIF1ATP53HTTMRGPRX4HDAC8
SCHEMBL8621955 0.94 HIF1A (0.48) HIF1ATP53HTTMRGPRX4KDM4E
SCHEMBL8621954 0.94 HIF1A (0.48) HIF1ATP53HTTMRGPRX4KDM4E
SCHEMBL8369599 0.91 HIF1A (0.51) HIF1ATP53HTTMRGPRX4HDAC8
SCHEMBL8369597 0.91 HIF1A (0.51) HIF1ATP53HTTMRGPRX4HDAC8
SCHEMBL8371706 0.91 HIF1A (0.53) HIF1ATP53HTTMRGPRX4HDAC8
SCHEMBL8368518 0.91 HIF1A (0.48) HIF1ATP53HTTMRGPRX4HDAC8
SCHEMBL8371708 0.91 HIF1A (0.53) HIF1ATP53HTTMRGPRX4HDAC8
SCHEMBL8368516 0.91 HIF1A (0.48) HIF1ATP53HTTMRGPRX4HDAC8
SCHEMBL8620579 0.90 HIF1A (0.48) HIF1ATP53HTTMRGPRX4HDAC8

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