SCHEMBL7584590

SCHEMBL7584590

CCCCOC(=O)c1ccccc1C(=O)OCc1ccccc1.O=C(OC1CCCCC1)c1ccccc1C(=O)OC1CCCCC1

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.73
TSHR P16473 4/20 0.73
TDP1 Q9NUW8 3/20 0.73
L3MBTL1 Q9Y468 3/20 0.73
CYP3A4 P08684 2/20 0.73
MAPK1 P28482 2/20 0.73
TP53 P04637 1/20 0.52
LMNA P02545 1/20 0.51
HSD17B10 Q99714 2/20 0.48
BCHE P06276 4/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
SCN1A P35498 2/20 0.43
SCN2A Q99250 2/20 0.43
SCN3A Q9NY46 2/20 0.43
HTT P42858 1/20 0.42

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
SCHEMBL31020921 0.92 TSHR (0.68) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL271491 0.92 TSHR (0.68) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
Dibutyl Phthalate SCHEMBL28523512 0.92 TSHR (0.68) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
Benzyl Salicylate SCHEMBL8071084 0.90 ALDH1A1 (0.58) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL6027304 0.89 ALDH1A1 (0.60) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL28095256 0.88 ALDH1A1 (0.68) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL19667986 0.88 TSHR (0.68) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL23930320 0.87 ALDH1A1 (0.69) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL11131188 0.87 ALDH1A1 (0.69) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL14628672 0.87 ALDH1A1 (0.69) ALDH1A1TSHRTDP1L3MBTL1CYP3A4

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
EP-0603384-B1 HOT MELT ADHESIVE COMPOSITION FULLER H B LICENSING FINANC (US) 2002-10-16 EP disclosed
US-5534575-A THERMOPLASTIC BLOCK COPOLYMER H. B. FULLER LICENSING & FINANCING, INC. (US) 1996-07-09 US disclosed
EP-0603384-A1 HOT MELT ADHESIVE COMPOSITION H.B. FULLER LICENSING & FINANCING, INC. (US) 1994-06-29 EP disclosed
WO-1994001509-A1 HOT MELT ADHESIVE COMPOSITION H.B. FULLER LICENSING & FINANCING, INC. (US) 1994-01-20 WO disclosed