SCHEMBL5451680

SCHEMBL5451680

C=CCCCC=CCOC(C)OC(=O)CCC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.39
ABCC4 O15439 1/20 0.39
LMNA P02545 3/20 0.36
ALDH1A1 P00352 1/20 0.36
USP2 O75604 2/20 0.35
RECQL P46063 2/20 0.35
CYP3A4 P08684 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
FAAH O00519 2/20 0.34
MGLL Q99685 1/20 0.34
TERT O14746 3/20 0.33
PTPN1 P18031 3/20 0.33
PPARG P37231 3/20 0.33
PPARD Q03181 3/20 0.33
PPARA Q07869 3/20 0.33
BLM P54132 2/20 0.33
HSD17B10 Q99714 2/20 0.33
FABP4 P15090 2/20 0.33
F7 P08709 2/20 0.33
F3 P13726 2/20 0.33

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
SCHEMBL4277449 0.82 EGLN1 (0.36) MAPTABCC4LMNAFAAHMGLL
SCHEMBL5447281 0.76 MAPT (0.37) MAPTABCC4LMNAALDH1A1USP2
SCHEMBL4277441 0.76 TDP1 (0.39) LMNAALDH1A1FAAHMGLLTDP1
SCHEMBL3635862 0.73 MAPT (0.37) MAPTABCC4LMNAALDH1A1USP2
SCHEMBL5451678 0.72 MAPT (0.41) MAPTABCC4LMNAALDH1A1USP2
SCHEMBL5447277 0.71 LMNA (0.41) MAPTLMNAALDH1A1USP2RECQL
SCHEMBL5447279 0.71 MAPT (0.37) MAPTABCC4LMNAALDH1A1USP2
SCHEMBL8598158 0.71 TSHR (0.44) MAPTABCC4LMNAALDH1A1USP2
SCHEMBL8810390 0.71 TSHR (0.44) MAPTABCC4LMNAALDH1A1USP2
SCHEMBL875951 0.71 MAPT (0.38) MAPTLMNAALDH1A1USP2RECQL

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-20070060713-A1 Reactive diluents in coating formulation BP CHEMICALS LIMITED (GB) 2007-03-15 US disclosed
EP-1620515-B1 REACTIVE DILUENTS IN COATING FORMULATION UNIV SOUTHERN MISSISSIPPI RES (US) 2006-12-27 EP disclosed
EP-1620515-A1 REACTIVE DILUENTS IN COATING FORMULATION The University of Southern Mississippi Research Foundation (US) 2006-02-01 EP disclosed
WO-2004099329-A1 REACTIVE DILUENTS IN COATING FORMULATION THE UNIVERSITY OF SOUTHERN MISSISSIPPI RESEARCH FOUNDATION (US) 2004-11-18 WO disclosed