SCHEMBL5707887

SCHEMBL5707887

O=C(CCn1ccnn1)OCCO

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.34
MGLL Q99685 1/20 0.34
CYP19A1 P11511 5/20 0.32
CYP1A1 P04798 2/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
MAPT P10636 1/20 0.31
BLM P54132 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
ATP4A P20648 1/20 0.30
ATP4B P51164 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
SCHEMBL19821311 0.83 FOLH1 (0.36) FOLH1MGLLCYP19A1CYP1A1
SCHEMBL10065548 0.78 TSHR (0.41) FOLH1CYP19A1CYP1A1MAPT
SCHEMBL28759039 0.77 FOLH1 (0.34) FOLH1CYP19A1CYP1A1SLC6A2SLC6A4
SCHEMBL5707875 0.77 THRB (0.42) MGLL
SCHEMBL27482656 0.75 FOLH1 (0.41) FOLH1CYP19A1CYP1A1
SCHEMBL10065552 0.74 TSHR (0.39) FOLH1CYP19A1MAPTATP4AATP4B
SCHEMBL956921 0.73 EGLN3 (0.46) FOLH1CYP19A1CYP1A1
SCHEMBL10082082 0.73 TNF (0.46)
SCHEMBL255015 0.72
SCHEMBL21570204 0.72 EGLN3 (0.44) FOLH1CYP19A1CYP1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105849210-B Dispersants having multiple aromatic imide anchoring groups 路博润先进材料公司 2019-12-13 CN disclosed
EP-3063240-A1 DISPERSANT'S WITH MULTIPLE AROMATIC IMIDE ANCHOR GROUPS Lubrizol Advanced Materials, Inc. (US) 2016-09-07 EP disclosed
WO-2015066156-A1 DISPERSANT'S WITH MULTIPLE AROMATIC IMIDE ANCHOR GROUPS LUBRIZOL ADVANCED MATERIALS, INC. (US) 2015-05-07 WO disclosed
WO-2015065829-A1 DISPERSANTS WITH MULTIPLE AROMATIC IMIDE ANCHOR GROUPS LUBRIZOL ADVANCED MATERIALS, INC. (US) 2015-05-07 WO disclosed
EP-1089809-B1 POLYURETHANE DISPERSANTS LUBRIZOL CORP (US) 2006-10-18 EP disclosed
US-6509409-B1 A dispersant comprising the addition product of a polyisocyanate having an average functionality of from 2 to 10 and one or more poly(oxyalkylene carbonyl) chains (POAC chain) such as those containing a POAC chain derived from AVECIA LIMITED (GB) 2003-01-21 US disclosed
EP-1089809-A1 POLYURETHANE DISPERSANTS Avecia Limited (GB) 2001-04-11 EP disclosed
WO-1999056864-A1 POLYURETHANE DISPERSANTS AVECIA LIMITED (GB) 1999-11-11 WO disclosed
US-5882393-A REACTION PRODUCT OF POLYISOCYANATES WITH A COMPOUND OF RING STRUCTURE WITH AT LEAST ONE NITROGEN ATOM IN RING; LACQUER EFKA CHEMICALS B.V. (NL) 1999-03-16 US disclosed