SCHEMBL4448153

SCHEMBL4448153

CCOc1cc(OCC)c(C=CC(=O)c2c(OCC)cc(OCC)cc2OCC)c(OCC)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 1/20 0.48
SLC5A2 P31639 1/20 0.48
AURKA O14965 1/20 0.47
ABCG2 Q9UNQ0 3/20 0.44
XDH P47989 1/20 0.42
KDM4E B2RXH2 3/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
PKM P14618 1/20 0.41
MAOB P27338 2/20 0.41
MAOA P21397 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL4448152 1.00 SLC5A1 (0.48) SLC5A1SLC5A2AURKAABCG2XDH
SCHEMBL4453938 0.88 AURKA (0.65) AURKAABCG2KDM4EMAPTLMNA
SCHEMBL4453943 0.88 AURKA (0.65) AURKAABCG2KDM4EMAPTLMNA
SCHEMBL4608140 0.82 MAPT (0.64) ABCG2KDM4EMAPTLMNAALDH1A1
SCHEMBL4608138 0.82 MAPT (0.64) ABCG2KDM4EMAPTLMNAALDH1A1
SCHEMBL4455655 0.79 AURKA (0.69) AURKAABCG2MAPTMAOBMAOA
SCHEMBL4455661 0.79 AURKA (0.69) AURKAABCG2MAPTMAOBMAOA
SCHEMBL10845017 0.76 SLC5A1 (0.79) SLC5A1SLC5A2ABCG2MAPTNPC1
SCHEMBL10845023 0.76 SLC5A1 (0.79) SLC5A1SLC5A2ABCG2MAPTNPC1
SCHEMBL30384723 0.76 SLC5A1 (0.79) SLC5A1SLC5A2ABCG2MAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090182058-A1 Novel Chalcone Derivatives With Antimitotic Activity UNIVERSITE JOSEPH FOURIER GRENOBLE I (FR) 2009-07-16 US claimed
US-20090182058-A1 Novel Chalcone Derivatives With Antimitotic Activity UNIVERSITE JOSEPH FOURIER GRENOBLE I (FR) 2009-07-16 US disclosed
EP-1976818-A2 CHALCONE DERIVATIVES WITH ANTIMITOTIC ACTIVITY UNIVERSITE CLAUDE BERNARD - LYON 1 (FR) 2008-10-08 EP disclosed
WO-2007083060-A2 NOVEL CHALCONE DERIVATIVES WITH ANTIMITOTIC ACTIVITY UNIVERSITE CLAUDE BERNARD LYON I (FR) 2007-07-26 WO 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-20090182058-A1 Novel Chalcone Derivatives With Antimitotic Activity ABCE1, CCNE1, FOXM1 SLC5A1 2174/4885SLC5A2 2736/4885AURKA 747/4885

“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.