SCHEMBL4379037

SCHEMBL4379037

CCc1c(CC=O)cc(OCc2ccccc2)cc1OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.43
MAOA P21397 1/20 0.43
MAPK14 Q16539 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GAA P10253 1/20 0.41
HDAC8 Q9BY41 1/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 1/20 0.40
CCNB2 O95067 2/20 0.40
CDK1 P06493 2/20 0.40
CDK4 P11802 2/20 0.40
CCNB1 P14635 2/20 0.40
CCND1 P24385 2/20 0.40
CCNB3 Q8WWL7 2/20 0.40
PIN1 Q13526 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 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
SCHEMBL4380772 0.80 CYP4F2 (0.51) MAOBMAPK14MEN1KMT2ALMNA
SCHEMBL4383939 0.80 PIN1 (0.45) MAOBMAOAMEN1KMT2ACCNB2
SCHEMBL1841867 0.80 L3MBTL1 (0.49) MAOBMAOAMEN1KMT2AGAA
SCHEMBL28671704 0.80 MEN1 (0.48) MAOBMAOAMEN1KMT2ALMNA
SCHEMBL3959610 0.79 MAOB (0.51) MAOBMAOALMNACCNB2CDK1
SCHEMBL6203294 0.79 MAOB (0.51) MAOBMAOALMNACCNB2CDK1
SCHEMBL4381103 0.79 MTNR1A (0.45) MAOBMEN1KMT2AHDAC8L3MBTL1
SCHEMBL955846 0.76 MAOB (0.54) MAOBMAOAMEN1KMT2ACCNB2
SCHEMBL4400180 0.76 MEN1 (0.54) MAOBMEN1KMT2AKDM4EL3MBTL1
SCHEMBL6887763 0.76 HDAC8 (0.53) MAOBGAAHDAC8KDM4EMAPT

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
US-7538241-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
EP-1704856-A1 HSP90 FAMILY PROTEIN INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-09-27 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070155813-A1 Hsp90 family protein inhibitors HSP90AB1, HEATR1, HSP90AB2P MAOB 3920/4885MAOA 4162/4885MAPK14 1693/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.