SCHEMBL7125968

SCHEMBL7125968

COc1ccc(OC)c(C(=O)C2C(c3ccc(N(C)C)c(O)c3)C2(Cl)Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
KDM4E B2RXH2 3/20 0.41
LMNA P02545 3/20 0.41
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
POLB P06746 1/20 0.38
TUBB1 Q9H4B7 1/20 0.38
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
ALDH1A1 P00352 2/20 0.36
TSHR P16473 2/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
HPGD P15428 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL6853088 0.89 MAPT (0.44) MAPTKDM4ELMNAHTTNPSR1
SCHEMBL6321116 0.89 MAPT (0.38) MAPTKDM4ELMNAHTTNPSR1
SCHEMBL7116814 0.88 MAPT (0.42) MAPTKDM4ELMNAHTTNPSR1
SCHEMBL7034852 0.86 MAPT (0.41) MAPTKDM4ELMNAHTTNPSR1
SCHEMBL6861248 0.86 POLB (0.43) MAPTKDM4ELMNAHTTNPSR1
SCHEMBL7119970 0.85 TUBB1 (0.50) MAPTKDM4ELMNAHTTNPSR1
SCHEMBL7125986 0.84 MAPT (0.49) MAPTKDM4ELMNAHTTNPSR1
SCHEMBL6317883 0.84 MAPT (0.35) MAPTKDM4ELMNAHTTNPSR1
SCHEMBL6858593 0.81 MAPT (0.44) MAPTKDM4ELMNAHTTNPSR1
SCHEMBL7128901 0.81 TUBB1 (0.38) MAPTLMNATUBB1ALDH1A1ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030149072-A1 Substituted arylcycloalkanes, compositions containing them and use thereof AVENTIS PHARMA S.A. (FR) 2003-08-07 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-20030149072-A1 Substituted arylcycloalkanes, compositions containing them and use thereof ABL1, MCL1, AHR MAPT 4538/4885KDM4E 1243/4885LMNA 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.