SCHEMBL1037264

SCHEMBL1037264

CN(CC(=O)c1ccc(Cl)cc1)Cc1cccc(OCCCO)c1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.47
ACHE P22303 8/20 0.44
BCHE P06276 4/20 0.44
CD274 Q9NZQ7 1/20 0.44
KDM4E B2RXH2 2/20 0.43
TMEM97 Q5BJF2 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 1/20 0.42
ATM Q13315 1/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 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
SCHEMBL1038530 0.91 ACHE (0.47) ACHEBCHECD274KDM4ETMEM97
SCHEMBL5992516 0.90 KDM4E (0.47) ACHEBCHECD274KDM4ETMEM97
SCHEMBL1035892 0.89 SLC2A1 (0.49) SLC2A1ACHEBCHESIGMAR1ALDH1A1
SCHEMBL1032923 0.87 ACHE (0.43) ACHEBCHECD274KDM4ESMN1; SMN2
SCHEMBL1036964 0.86 MEN1 (0.45) ACHEBCHECD274KDM4ETMEM97
SCHEMBL1037998 0.86 ACHE (0.42) ACHEBCHECD274
SCHEMBL1038386 0.86 TMEM97 (0.47) SLC2A1ACHEBCHECD274KDM4E
SCHEMBL1035600 0.86 SMN1; SMN2 (0.45) ACHEBCHECD274SMN1; SMN2ALDH1A1
SCHEMBL1036749 0.85 KDM4E (0.48) ACHEBCHECD274KDM4EALDH1A1
SCHEMBL1033735 0.85 KDM4E (0.44) SLC2A1ACHEBCHECD274KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1831173-B1 TETRAHYDROISOQUINOLINE COMPOUNDS FOR TREATMENT OF CNS DISORDERS JANSSEN PHARMACEUTICA NV (BE) 2011-01-26 EP disclosed
US-20060194837-A1 Tetrahydroisoquinoline compounds JANSSEN PHARMACEUTICA N.V. (BE) 2006-08-31 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-20060194837-A1 Tetrahydroisoquinoline compounds HRH3, HRH4, HRH1 SLC2A1 376/4885ACHE 2621/4885BCHE 427/4885

“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.