SCHEMBL7799554

SCHEMBL7799554

CCCCOc1cc(Cl)c(OCCCC)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.54
GLA P06280 1/20 0.54
THRB P10828 3/20 0.49
THRA P10827 1/20 0.49
BACE1 P56817 1/20 0.47
CSNK2A1 P68400 2/20 0.47
ATM Q13315 2/20 0.46
L3MBTL1 Q9Y468 4/20 0.46
ALDH1A1 P00352 3/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
CYP1A2 P05177 1/20 0.45
NPSR1 Q6W5P4 2/20 0.45
TSHR P16473 2/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 2/20 0.43
RAB9A P51151 2/20 0.43
MEN1 O00255 2/20 0.43
HPGD P15428 2/20 0.43

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
SCHEMBL12967934 0.96 GLA (0.51) SMN1; SMN2GLATHRBTHRABACE1
SCHEMBL8944412 0.88 GLA (0.50) SMN1; SMN2GLATHRBTHRABACE1
SCHEMBL14421841 0.86 MCOLN3 (0.48) SMN1; SMN2GLATHRBTHRABACE1
SCHEMBL26930436 0.86 CYP1A2 (0.52) SMN1; SMN2GLATHRBTHRABACE1
SCHEMBL12161176 0.84 MAOA (0.56) SMN1; SMN2GLATHRBTHRABACE1
SCHEMBL12161089 0.84 SMN1; SMN2 (0.46) SMN1; SMN2GLATHRBTHRABACE1
SCHEMBL14036397 0.83 SMN1; SMN2 (0.45) SMN1; SMN2GLATHRBTHRABACE1
SCHEMBL14015795 0.82 THRB (0.51) SMN1; SMN2GLATHRBTHRAATM
SCHEMBL3790208 0.81 KDM4E (0.51) SMN1; SMN2GLATHRBTHRAL3MBTL1
SCHEMBL3785500 0.81 SMN1; SMN2 (0.59) SMN1; SMN2GLATHRBTHRABACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0599886-B1 MACROMONOMERS HAVING REACTIVE END GROUPS MISSISSIPPI POLYMER TECH INC (US) 2001-03-21 EP disclosed
US-5973075-A POLYPHENYL RESINS MAXDEM INCORPORATION (US) 1999-10-26 US disclosed
US-5827927-A Macromonomers having reactive end groups MAXDEM INCORPORATED (US) 1998-10-27 US disclosed
US-5824744-A RIGID POLYMER RODS AND MACROMONOMERS WITH REACTIVE END GROUPS FOR REINFORCEMENT MAXDEM INCORPORATED (US) 1998-10-20 US disclosed
US-5670564-A Macromonomers having reactive end groups MAXDEM INCORPORATED (US) 1997-09-23 US disclosed