SCHEMBL1581980

SCHEMBL1581980

O=C(O)N1CCC(CCn2ccc3ccccc32)CC1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.51
MTNR1B P49286 2/20 0.51
LMNA P02545 1/20 0.49
KMT2A Q03164 1/20 0.49
CDK4 P11802 1/20 0.49
CCND1 P24385 1/20 0.49
ACHE P22303 1/20 0.48

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
SCHEMBL1581511 0.88 KMT2A (0.53) MTNR1AMTNR1BLMNAKMT2ACDK4
SCHEMBL5449468 0.81 LMNA (0.50) MTNR1AMTNR1BLMNACDK4CCND1
SCHEMBL1581454 0.80 MTNR1A (0.50) MTNR1AACHE
SCHEMBL15526048 0.79 KRAS (0.47) LMNAACHE
SCHEMBL4290177 0.78 LMNA (0.45) MTNR1AMTNR1BLMNAKMT2ACDK4
SCHEMBL26192630 0.77 CDK4 (0.50) CDK4CCND1ACHE
SCHEMBL1581855 0.77 LMNA (0.67) LMNAACHE
SCHEMBL9635379 0.76 CDK4 (0.56) MTNR1AMTNR1BLMNACDK4CCND1
Hydrochloric Acid SCHEMBL4292429 0.76 LMNA (0.43) MTNR1AMTNR1BLMNAKMT2ACDK4
Hydrochloric Acid SCHEMBL4293143 0.76 LMNA (0.43) MTNR1AMTNR1BLMNAKMT2ACDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1720872-B1 ARYL AND HETEROARYL-PIPERIDINECARBOXYLATE DERIVATIVES, THE PREPARATION AND THE USE THEREOF IN THE FORM OF FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2011-04-20 EP disclosed
EP-1720872-A1 ARYL AND HETEROARYL-PIPERIDINECARBOXYLATE DERIVATIVES, THE PREPARATION AND THE USE THEREOF IN THE FORM OF FAAH ENZYME INHIBITORS Sanofi-Aventis (FR) 2006-11-15 EP disclosed
WO-2005090347-A1 ARYL AND HETEROARYL-PIPERIDINECARBOXYLATE DERIVATIVES, THE PREPARATION AND THE USE THEREOF IN THE FORM OF FAAH ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2005-09-29 WO disclosed