SCHEMBL16010374

SCHEMBL16010374

[CH2]CCC(CCCCCCCCC)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.43
HTR2A P28223 1/20 0.41
CSNK1E P49674 1/20 0.41
OPRM1 P35372 2/20 0.40
OPRD1 P41143 2/20 0.40
OPRK1 P41145 2/20 0.40
OPRL1 P41146 2/20 0.40
NAAA Q02083 2/20 0.40
SIGMAR1 Q99720 1/20 0.40
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
KCNH2 Q12809 1/20 0.38
ASAH1 Q13510 1/20 0.38
CYP19A1 P11511 3/20 0.37

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
SCHEMBL7262623 1.00 NR1I2 (0.43) NR1I2HTR2ACSNK1EOPRM1OPRD1
SCHEMBL15563657 0.98 SIGMAR1 (0.41) NR1I2HTR2ACSNK1EOPRM1OPRD1
SCHEMBL10597887 0.93 NR1I2 (0.43) NR1I2HTR2ACSNK1EOPRM1OPRD1
SCHEMBL10978603 0.93 NR1I2 (0.43) NR1I2HTR2ACSNK1EOPRM1OPRD1
SCHEMBL5933904 0.93 NR1I2 (0.43) NR1I2HTR2ACSNK1EOPRM1OPRD1
SCHEMBL29165486 0.93 NR1I2 (0.43) NR1I2HTR2ACSNK1EOPRM1OPRD1
SCHEMBL15563133 0.93 NR1I2 (0.43) NR1I2HTR2ACSNK1EOPRM1OPRD1
SCHEMBL6110984 0.93 POLB (0.41) HTR2AOPRM1OPRD1OPRK1OPRL1
SCHEMBL1921279 0.91 SIGMAR1 (0.41) NR1I2HTR2ACSNK1EOPRM1OPRD1
SCHEMBL23849703 0.91 NR1I2 (0.49) NR1I2HTR2ACSNK1EOPRM1OPRD1

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-9889438-B2 Zeolite core/silica zeolite shell composite, preparing method of the same, and catalyst including the same Sogang University Research Foundation (KR) 2018-02-13 US disclosed
US-20140256538-A1 ZEOLITE CORE/SILICA ZEOLITE SHELL COMPOSITE, PREPARING METHOD OF THE SAME, AND CATALYST INCLUDING THE SAME Sogang University Research Foundation (KR) 2014-09-11 US disclosed