SCHEMBL3716140

SCHEMBL3716140

CCCCCC([N+]1(C)CCCC1)[N+]1(C)CCCC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.36
LMNA P02545 1/20 0.33
DNM1 Q05193 2/20 0.32
FDPS P14324 4/20 0.31
TSHR P16473 1/20 0.30
THRB P10828 1/20 0.30
GPR84 Q9NQS5 3/20 0.30
SPHK1 Q9NYA1 1/20 0.30
FFAR1 O14842 1/20 0.30
CA1 P00915 1/20 0.30

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
SCHEMBL1649837 0.98 OPRM1 (0.34) OPRM1LMNADNM1FDPS
SCHEMBL3953514 0.98 LMNA (0.37) OPRM1LMNADNM1FDPSTSHR
SCHEMBL3722070 0.96 LMNA (0.35) OPRM1LMNADNM1FDPSTSHR
SCHEMBL2912414 0.91 DNM1 (0.32) DNM1
SCHEMBL1765996 0.81
SCHEMBL24419498 0.77 OPRM1 (0.37) OPRM1LMNADNM1FDPSTSHR
SCHEMBL29112748 0.77 LCK (0.34) OPRM1LMNA
SCHEMBL5288523 0.77 LMNA (0.43) OPRM1LMNADNM1FDPSTSHR
SCHEMBL1253417 0.77 LMNA (0.43) OPRM1LMNADNM1FDPSTSHR
SCHEMBL5294847 0.77 LMNA (0.43) OPRM1LMNADNM1FDPSTSHR

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-3188827-A1 EMM-26, A NOVEL SYNTHETIC CRYSTALLINE MATERIAL, ITS PREPARATION, AND ITS USE Exxonmobil Research And Engineering Company (US) 2017-07-12 EP claimed
WO-2016036590-A1 EMM-26, A NOVEL SYNTHETIC CRYSTALLINE MATERIAL, ITS PREPARATION, AND ITS USE EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2016-03-10 WO claimed
WO-2010099441-A2 SYNTHESIS OF MOLECULAR SIEVE SSZ-74 USING A HYDROXIDE-MEDIATED GEL CHEVRON U.S.A. INC. (US) 2010-09-02 WO claimed
EP-3188827-A1 EMM-26, A NOVEL SYNTHETIC CRYSTALLINE MATERIAL, ITS PREPARATION, AND ITS USE Exxonmobil Research And Engineering Company (US) 2017-07-12 EP disclosed
WO-2016036590-A1 EMM-26, A NOVEL SYNTHETIC CRYSTALLINE MATERIAL, ITS PREPARATION, AND ITS USE EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2016-03-10 WO disclosed
WO-2010099441-A2 SYNTHESIS OF MOLECULAR SIEVE SSZ-74 USING A HYDROXIDE-MEDIATED GEL CHEVRON U.S.A. INC. (US) 2010-09-02 WO disclosed