SCHEMBL11296902

SCHEMBL11296902

O=P(Oc1cc(Cl)c(Cl)c(Cl)c1Cl)(Oc1cc(Cl)c(Cl)c(Cl)c1Cl)Oc1cc(Cl)c(Cl)c(Cl)c1Cl

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.43
AKR1B1 P15121 1/20 0.40
TSHR P16473 3/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HSP90AA1 P07900 1/20 0.36
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MAPK1 P28482 2/20 0.32
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
INPPL1 O15357 1/20 0.31
INPP5B P32019 1/20 0.31
INPP5A Q14642 1/20 0.31
AHR P35869 1/20 0.30

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
SCHEMBL258267 0.77 LMNA (0.36) CYP3A4TSHRLMNASMN1; SMN2MAPK1
SCHEMBL10715975 0.72 AKR1B1 (0.61) CYP3A4AKR1B1TSHRHPGDHSD17B10
SCHEMBL29749799 0.69 CYP3A4 (0.50) CYP3A4AKR1B1TSHRHPGDHSD17B10
SCHEMBL914797 0.69 CYP3A4 (0.50) CYP3A4AKR1B1TSHRHPGDHSD17B10
SCHEMBL25269222 0.68 LMNA (0.33) CYP3A4LMNASMN1; SMN2MAPK1TDP1
SCHEMBL28632461 0.68 CYP3A4 (0.43) CYP3A4AKR1B1TSHRHPGDHSD17B10
SCHEMBL11230910 0.68 AKR1B1 (0.45) CYP3A4AKR1B1TSHRHPGDHSD17B10
SCHEMBL28202875 0.68 CYP3A4 (0.43) CYP3A4AKR1B1TSHRHPGDHSD17B10
SCHEMBL28632460 0.68 CYP3A4 (0.43) CYP3A4AKR1B1TSHRHPGDHSD17B10
SCHEMBL11599512 0.67 ALOX15 (0.34) CYP3A4TSHRHSP90AA1LMNASMN1; SMN2

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
EP-0050410-A1 Method of enhancing flammability resistance of polyparabanic acid films by the addition of copper chelates and films thus formed EXXON RESEARCH AND ENGINEERING COMPANY (US) 1982-04-28 EP claimed