SCHEMBL4373835

SCHEMBL4373835

C=CC(c1ccccc1)C(CCCCCCCC)C(N)(CC)CC

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.37
CSNK1E P49674 1/20 0.36
OPRM1 P35372 3/20 0.33
OPRD1 P41143 3/20 0.33
OPRK1 P41145 3/20 0.33
OPRL1 P41146 3/20 0.33
NAAA Q02083 2/20 0.33
LMNA P02545 1/20 0.33
KCNH2 Q12809 3/20 0.32
SIGMAR1 Q99720 1/20 0.32
ASAH1 Q13510 1/20 0.32

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
SCHEMBL4925546 0.88 HTR2A (0.38) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL4378999 0.88 HTR2A (0.38) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL5277955 0.88 HTR2A (0.38) HTR2ACSNK1EOPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL2460225 0.86 HTR2A (0.37) HTR2ACSNK1EOPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL2460431 0.86 HTR2A (0.37) HTR2ACSNK1EOPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL850166 0.86 HTR2A (0.37) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL4379088 0.84 HTR2A (0.34) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL4374773 0.82 HTR2A (0.35) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL9602487 0.79 CSNK1E (0.47) HTR2ACSNK1EOPRM1OPRD1OPRK1
SCHEMBL28916426 0.76 LMNA (0.39) HTR2ACSNK1EOPRM1OPRD1OPRK1

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
US-20090081696-A1 LUMINESCENCE ENHANCER AND USE THEREOF FUJIREBIO INC. (JP) 2009-03-26 US disclosed
EP-2028250-A1 LUMINESCENCE ENHANCER FUJIREBIO INC. (JP) 2009-02-25 EP disclosed