SCHEMBL8926766

SCHEMBL8926766

CCOC(OCC)c1ccccc1N(CC)CC

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 1/20 0.32
NR3C1 P04150 1/20 0.31
AR P10275 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
CNR2 P34972 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
SCHEMBL5377770 0.83 ALDH1A1 (0.34) L3MBTL1TSHRALDH1A1GAAMAPT
SCHEMBL30125051 0.78 TSHR (0.38) L3MBTL1TSHRNR3C1ARALDH1A1
SCHEMBL1552804 0.78 TSHR (0.38) L3MBTL1TSHRNR3C1ARALDH1A1
SCHEMBL29173184 0.76 GABRA1 (0.41) L3MBTL1TSHRARCNR2
SCHEMBL11795724 0.75 TSHR (0.37) L3MBTL1TSHRALDH1A1
SCHEMBL7121874 0.75 TSHR (0.35) L3MBTL1TSHRARALDH1A1MAPT
SCHEMBL3730184 0.73 TSHR (0.35) L3MBTL1TSHRARALDH1A1CNR2
SCHEMBL699772 0.72 ALDH1A1 (0.38) L3MBTL1TSHRALDH1A1MAPT
SCHEMBL898540 0.72 ESR1 (0.50) L3MBTL1TSHRALDH1A1GAA
SCHEMBL31718395 0.72 TSHR (0.46) L3MBTL1TSHRNR3C1ARALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5676884-A Nonlinear optical materials containing polar disulfone-functionalized molecules MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-10-14 US disclosed
US-5578251-A NONLINEAR-OPTICAL RESPONSE; ALKYLATION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-11-26 US disclosed
US-5360582-A Compositions with polymers for light sensitive elements MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-11-01 US disclosed
EP-0594697-A1 NONLINEAR OPTICAL MATERIALS CONTAINING POLAR DISULFONE-FUNCTIONALIZED MOLECULES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-05-04 EP disclosed
WO-1993002383-A1 NONLINEAR OPTICAL MATERIALS CONTAINING POLAR DISULFONE-FUNCTIONALIZED MOLECULES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-02-04 WO disclosed