SCHEMBL277281

SCHEMBL277281

CCOC(=O)c1c(C)ccc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.57
KDM4E B2RXH2 4/20 0.57
MAPK1 P28482 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
CDC25B P30305 2/20 0.55
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA7 P43166 1/20 0.51
CA9 Q16790 1/20 0.51
CA14 Q9ULX7 1/20 0.51
CDC25A P30304 1/20 0.51
CDC25C P30307 1/20 0.51
ALDH1A1 P00352 4/20 0.50
GAA P10253 2/20 0.50
TSHR P16473 1/20 0.50
GLA P06280 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
MEN1 O00255 2/20 0.49
NPC1 O15118 2/20 0.49

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
SCHEMBL29856064 0.85 CDC25B (0.61) KMT2AKDM4EMAPK1L3MBTL1CDC25B
SCHEMBL10051639 0.85 CDC25B (0.54) KMT2AKDM4EMAPK1L3MBTL1CDC25B
SCHEMBL560585 0.85 CDC25B (0.61) KMT2AKDM4EMAPK1L3MBTL1CDC25B
SCHEMBL28257925 0.85 CA12 (0.64) KMT2AKDM4EMAPK1L3MBTL1CDC25B
SCHEMBL27595698 0.84 KMT2A (0.53) KMT2AKDM4EMAPK1L3MBTL1CDC25B
Butane SCHEMBL7938601 0.84 CDC25B (0.60) KMT2AKDM4EMAPK1L3MBTL1CDC25B
SCHEMBL27553344 0.84 CDC25B (0.52) KMT2AKDM4EMAPK1L3MBTL1CDC25B
SCHEMBL1648076 0.83 NCEH1 (0.59) KMT2AKDM4EMAPK1CA12CA1
SCHEMBL5835576 0.83 CA12 (0.55) KMT2AKDM4EMAPK1L3MBTL1CDC25B
SCHEMBL11056026 0.83 CDC25B (0.55) KMT2AKDM4EMAPK1L3MBTL1CDC25B

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-8134005-B2 Preparation and use of magnesium amides Ludwig-Maximilians-Universitat München (DE) 2012-03-13 US disclosed
US-20100144516-A1 PREPARATION AND USE OF MAGNESIUM AMIDES LUDWIG-MAXIMILIANS-UNIVERSITAT MUNCHEN (DE) 2010-06-10 US disclosed
US-20090176988-A1 Preparation and Use of Magnesium Amides LUDWIG-MAXIMILIANS-UNIVERSITAT MUENCHEN (DE) 2009-07-09 US 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-20090176988-A1 Preparation and Use of Magnesium Amides MLX, GLRX3, SFXN3 KMT2A 1480/4885KDM4E 3049/4885MAPK1 2539/4885

“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.