SCHEMBL6929790

SCHEMBL6929790

CCCC(C)(C)OOC(=O)OCCOCCOC(=O)OOC(C)(C)CCC

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
TSHR P16473 3/20 0.34
HSD17B10 Q99714 2/20 0.34
LMNA P02545 1/20 0.34
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
THRB P10828 2/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31

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
SCHEMBL6923591 0.88 DGKA (0.37) ALDH1A1CYP4F2CYP4A11THRB
SCHEMBL5545986 0.86 ALDH1A1 (0.32) ALDH1A1TSHRCYP4F2CYP4A11THRB
SCHEMBL7059827 0.86 ATM (0.46) ALDH1A1TSHRHSD17B10LMNA
SCHEMBL11516812 0.85 MAPT (0.36) ALDH1A1TSHRHSD17B10CYP4F2CYP4A11
SCHEMBL6930648 0.85 TSHR (0.36) ALDH1A1TSHRHSD17B10CYP4F2CYP4A11
SCHEMBL11515685 0.84 MEN1 (0.42) TSHRCYP4F2CYP4A11THRB
SCHEMBL8387306 0.84 NAAA (0.43) ALDH1A1TSHRLMNATP53
SCHEMBL5544364 0.84
SCHEMBL6927551 0.83 HCAR2 (0.38) ALDH1A1TSHRHSD17B10LMNA
SCHEMBL9625366 0.82 DGKA (0.40) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030013815-A1 Process for preparation of elastomer modified polymer compositions with enhanced rubber phase volume fraction ATOFINA CHEMICALS, INC. 2003-01-16 US disclosed
EP-1044994-A1 Process for preparation of elastomer modified polymer compositions with enhanced rubber phase volume fraction ATOFINA CHEMICALS, INC. (US) 2000-10-18 EP disclosed