SCHEMBL8325849

SCHEMBL8325849

CCCCCC(N)=CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
FAAH O00519 1/20 0.48
TP53 P04637 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C19 P33261 1/20 0.48
SOAT1 P35610 1/20 0.48
GPR84 Q9NQS5 7/20 0.48
PPARG P37231 7/20 0.48
PPARD Q03181 7/20 0.48
PPARA Q07869 7/20 0.48
HDAC11 Q96DB2 5/20 0.48
TSHR P16473 4/20 0.48
PTPN1 P18031 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TLR2 O60603 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
FABP4 P15090 2/20 0.48

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
SCHEMBL7148017 0.93 CES1 (0.44) AKR1B1MEN1KMT2AFAAHTP53
SCHEMBL7148023 0.93 CES1 (0.44) AKR1B1MEN1KMT2AFAAHTP53
SCHEMBL7148020 0.93 CES1 (0.44) AKR1B1MEN1KMT2AFAAHTP53
SCHEMBL5078045 0.86 TSHR (0.41) MEN1KMT2AFAAHTP53CYP1A2
SCHEMBL11876598 0.84 FAAH (0.50) AKR1B1MEN1KMT2AFAAHTP53
SCHEMBL11876603 0.84 FAAH (0.50) AKR1B1MEN1KMT2AFAAHTP53
SCHEMBL2076983 0.84
SCHEMBL3399798 0.84
SCHEMBL2191702 0.84
SCHEMBL12812666 0.83 FAAH (0.53) MEN1KMT2AFAAHTP53CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6005146-A IMPROVED ADHESION PROMOTERS FOR LATEX PAINTS EASTMAN CHEMICAL COMPANY (US) 1999-12-21 US disclosed
EP-0953019-A1 STABILIZED NON-POLYMERIC ACETOACETATE ESTERS THAT PROMOTE ADHESION TO METALLIC AND OXIDIZED SUBSTRATES EASTMAN CHEMICAL COMPANY (US) 1999-11-03 EP disclosed
US-5913970-A NONPOLYMERIC ENAMINE ADDED TO AN AQUEOUS DISPERSION POLYMER IN THE PRESENCE OF OTHER CONVENTIONAL PAINT ADDITIVES EASTMAN CHEMICAL COMPANY (US) 1999-06-22 US disclosed
WO-1998031753-A1 STABILIZED NON-POLYMERIC ACETOACETATE ESTERS THAT PROMOTE ADHESION TO METALLIC AND OXIDIZED SUBSTRATES EASTMAN CHEMICAL COMPANY (US) 1998-07-23 WO disclosed