SCHEMBL6314925

SCHEMBL6314925

COc1ccc(OC)c(C(=O)C2CCCCC2c2ccc(C)c(N)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NPSR1 Q6W5P4 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HTT P42858 2/20 0.40
ALDH1A1 P00352 5/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
KDM2B Q8NHM5 3/20 0.37
ALOX15 P16050 1/20 0.37
HPGD P15428 1/20 0.36
PDE4B Q07343 2/20 0.36
ABCG2 Q9UNQ0 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
SCHEMBL6316494 0.94 MAPT (0.43) KDM1AMAPTLMNAKDM4ENPSR1
SCHEMBL6853114 0.92 KDM1A (0.44) KDM1AMAPTLMNAKDM4ENPSR1
SCHEMBL6315628 0.89 KDM1A (0.42) KDM1AMAPTLMNAKDM4ENPSR1
SCHEMBL6316242 0.89 MAPT (0.45) KDM1AMAPTLMNAKDM4ENPSR1
SCHEMBL7119962 0.88 MAPT (0.42) KDM1AMAPTLMNAKDM4ENPSR1
SCHEMBL6320947 0.88 MAPT (0.40) KDM1AMAPTLMNAKDM4ENPSR1
SCHEMBL6853036 0.87 MAPT (0.45) KDM1AMAPTLMNAKDM4ENPSR1
SCHEMBL6322512 0.87 KDM1A (0.40) KDM1AMAPTLMNAKDM4ENPSR1
SCHEMBL6315292 0.87 MAPT (0.40) KDM1AMAPTLMNAKDM4ENPSR1
SCHEMBL7122963 0.86 MAPT (0.48) KDM1AMAPTLMNAKDM4ENPSR1

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-6887904-B2 Substituted arylcycloalkanes, compositions containing them and use thereof AVENTIS PHARMA S. A. (FR) 2005-05-03 US disclosed
EP-1453783-A1 SUBSTITUTED ARYL-CYCLOALKANES, AND USE THEREOF AS ANTICANCER AGENTS Aventis Pharma S.A. (FR) 2004-09-08 EP disclosed
US-20030149072-A1 Substituted arylcycloalkanes, compositions containing them and use thereof AVENTIS PHARMA S.A. (FR) 2003-08-07 US disclosed
WO-2003048096-A1 SUBSTITUTED ARYL-CYCLOALKANES, AND USE THEREOF AS ANTICANCER AGENTS AVENTIS PHARMA S.A. (FR) 2003-06-12 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-20030149072-A1 Substituted arylcycloalkanes, compositions containing them and use thereof ABL1, MCL1, AHR KDM1A 1764/4885MAPT 4538/4885LMNA 3280/4885

“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.