SCHEMBL7899783

SCHEMBL7899783

CCCCCCCCOC(=O)c1c(Br)c(Br)c(Br)c(Br)c1C(=O)O.CCCCCCCCOC(=O)c1c(Br)c(Br)c(Br)c(Br)c1C(=O)OCCCCCCCC.COC(=O)c1c(Br)c(Br)c(Br)c(Br)c1C(=O)OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
TSHR P16473 2/20 0.44
LMNA P02545 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPK1 P28482 1/20 0.42
EPHX1 P07099 1/20 0.41
ESR1 P03372 4/20 0.41
MAPT P10636 1/20 0.41
AKR1C4 P17516 1/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
AKR1C1 Q04828 1/20 0.41
FAAH O00519 1/20 0.41
NAAA Q02083 1/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL9856688 0.94 ALDH1A1 (0.49) ALDH1A1TSHRLMNANPC1RAB9A
SCHEMBL8470318 0.94 ALDH1A1 (0.49) ALDH1A1TSHRLMNANPC1RAB9A
SCHEMBL7995519 0.94 ALDH1A1 (0.49) ALDH1A1TSHRLMNANPC1RAB9A
SCHEMBL7946728 0.94 ALDH1A1 (0.49) ALDH1A1TSHRLMNANPC1RAB9A
SCHEMBL11871467 0.88 ESR1 (0.50) ALDH1A1TSHRLMNANPC1RAB9A
SCHEMBL7924047 0.88 ALDH1A1 (0.54) ALDH1A1TSHRLMNANPC1RAB9A
SCHEMBL7998788 0.88 ALDH1A1 (0.54) ALDH1A1TSHRLMNANPC1RAB9A
SCHEMBL7926397 0.88 ALDH1A1 (0.54) ALDH1A1TSHRLMNANPC1RAB9A
SCHEMBL7924052 0.88 ALDH1A1 (0.54) ALDH1A1TSHRLMNANPC1RAB9A
SCHEMBL10895696 0.88 ALDH1A1 (0.54) ALDH1A1TSHRLMNANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6190581-B1 MIXING SODIUM ANTIMONATE HYDRATE WITH A POLYMER AND ADDING TO VENTED OR VACUUM APPARATUS OR HIGH SHEAR BLENDER AT GIVEN HIGH TEMPERATURE RANGE TO PRODUCE A FLAMEPROOFING CONCENTRATE FOR ADDITION TO A POLYMER SUCH AS POLYETHYLENE TEREPHTHALATE LAUREL INDUSTRIES, INC. 2001-02-20 US claimed