SCHEMBL3279079

SCHEMBL3279079

CCCC/C(=C(/C)C(=O)O)N(CC)CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.46
FNTB P49356 2/20 0.46
THRB P10828 1/20 0.46
PGGT1B P53609 1/20 0.46
CES1 P23141 2/20 0.40
LMNA P02545 1/20 0.40
CES2 O00748 1/20 0.39
ALDH1A1 P00352 4/20 0.39
CA1 P00915 2/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
AKR1B1 P15121 1/20 0.37
TP53 P04637 1/20 0.37
PPARG P37231 6/20 0.35
PPARD Q03181 6/20 0.35
PPARA Q07869 6/20 0.35
GPR84 Q9NQS5 5/20 0.35
HDAC11 Q96DB2 5/20 0.35
TSHR P16473 4/20 0.35
TLR2 O60603 2/20 0.35

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
SCHEMBL8849975 0.94 FNTA (0.53) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL8849985 0.94 FNTA (0.53) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL500172 0.92 FNTA (0.56) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL8850166 0.92 FNTA (0.56) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL8850007 0.92 FNTA (0.56) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL8849848 0.92 FNTA (0.56) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL8849655 0.92 FNTA (0.56) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL634778 0.88 FNTA (0.39) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL2770803 0.88 FNTA (0.39) FNTAFNTBTHRBPGGT1BCES1
SCHEMBL7635712 0.86 FNTA (0.44) FNTAFNTBTHRBPGGT1BCES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070113353-A1 Polymeric Surface Treatment Compositions THE CLOROX COMPANY 2007-05-24 US claimed
WO-2022080235-A1 CONJUGATED DIENE POLYMER, RUBBER COMPOSITION, CROSSLINKED RUBBER PRODUCT, AND TIRE ZSエラストマー株式会社 2022-04-21 WO disclosed
WO-2022080236-A1 CONJUGATED-DIENE-BASED POLYMER, RUBBER COMPOSITION, CROSS-LINKED RUBBER OBJECT, AND TIRE ZSエラストマー株式会社 2022-04-21 WO disclosed
EP-3648806-A1 BIORESORBABLE SURFACE COATING FOR DELAYING DEGRADATION Drei Lilien PVG GmbH & Co. KG (DE) 2020-05-13 EP disclosed
WO-2019008192-A1 BIORESORBABLE SURFACE COATING FOR DELAYING DEGRADATION DREI LILIEN PVG GMBH & CO. KG (DE) 2019-01-10 WO disclosed
US-20100160487-A1 Polymeric Surface Treatment Compositions THE CLOROX COMPANY (US) 2010-06-24 US disclosed
US-7699941-B2 Polymeric surface treatment compositions THE CLOROX COMPANY (US) 2010-04-20 US disclosed
US-20070113353-A1 Polymeric Surface Treatment Compositions THE CLOROX COMPANY 2007-05-24 US disclosed