SCHEMBL6018340

SCHEMBL6018340

CN(CC1CCC(CCCN(CCO)CCO)CC1)C(=O)Oc1ccc(Cl)cc1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LSS P48449 13/20 0.67
BCHE P06276 3/20 0.38
LMNA P02545 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ACHE P22303 1/20 0.35

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
SCHEMBL6018344 1.00 LSS (0.67) LSSBCHELMNAL3MBTL1MAPT
SCHEMBL6019481 0.95 LSS (0.75) LSSBCHELMNAL3MBTL1ACHE
SCHEMBL6019477 0.95 LSS (0.75) LSSBCHELMNAL3MBTL1ACHE
SCHEMBL6018735 0.93 LSS (0.79) LSSBCHELMNAL3MBTL1ACHE
SCHEMBL6018736 0.93 LSS (0.79) LSSBCHELMNAL3MBTL1ACHE
SCHEMBL6018434 0.90 LSS (0.59) LSSLMNAL3MBTL1MAPTSMN1; SMN2
SCHEMBL6020013 0.90 LSS (0.59) LSSLMNAL3MBTL1MAPTSMN1; SMN2
SCHEMBL6018429 0.90 LSS (0.59) LSSLMNAL3MBTL1MAPTSMN1; SMN2
SCHEMBL6019885 0.90 LSS (0.59) LSSLMNAL3MBTL1MAPTSMN1; SMN2
SCHEMBL6019890 0.90 LSS (0.59) LSSLMNAL3MBTL1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1456171-B1 SUBSTITUTED CYCLOHEXANE DERIVATIVES HOFFMANN LA ROCHE (CH) 2006-12-20 EP disclosed
US-20050272774-A1 Substituted cyclohexane derivatives ACKERMANN JEAN 2005-12-08 US disclosed
US-6953806-B2 Substituted cyclohexane derivatives HOFFMANN-LA ROCHE INC. (US) 2005-10-11 US disclosed
EP-1456171-A1 SUBSTITUTED CYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2004-09-15 EP disclosed
US-20030199550-A1 Substituted cyclohexane derivatives F.HOFFMANN-LA ROCHE AG (CH) 2003-10-23 US disclosed
WO-2003053919-A1 SUBSTITUTED CYCLOHEXANE DERIVATIVES F. HOFFMANN-LA-ROCHE AG (CH) 2003-07-03 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 (2 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-20050272774-A1 Substituted cyclohexane derivatives LSS, CYP51A1, CYP8B1 LSS 1/4885BCHE 547/4885LMNA 280/4885
US-20030199550-A1 Substituted cyclohexane derivatives CYP51A1, LSS, CYP46A1 LSS 2/4885BCHE 681/4885LMNA 485/4885

“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.