SCHEMBL28617099

SCHEMBL28617099

Clc1cccc2c1oc1c(Cl)cccc12

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AHR P35869 5/20 0.69
CYP1A2 P05177 3/20 0.55
CYP2A6 P11509 3/20 0.55
TTR P02766 3/20 0.49
NR4A2 P43354 2/20 0.48
PSMB8 P28062 2/20 0.44
PSMB5 P28074 1/20 0.44
TSHR P16473 2/20 0.40
LMNA P02545 1/20 0.40
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL24627319 0.87 AHR (0.56) AHRCYP1A2CYP2A6TTRNR4A2
SCHEMBL21891046 0.87 AHR (0.56) AHRCYP1A2CYP2A6TTRNR4A2
SCHEMBL29536194 0.87 AHR (0.56) AHRCYP1A2CYP2A6TTRNR4A2
SCHEMBL24961949 0.87 AHR (0.56) AHRCYP1A2CYP2A6TTRNR4A2
SCHEMBL8815383 0.85 TTR (0.65) AHRCYP1A2CYP2A6TTRNR4A2
SCHEMBL21331586 0.85 AHR (0.55) AHRCYP1A2CYP2A6TTRNR4A2
SCHEMBL2283190 0.84 AHR (0.58) AHRCYP1A2CYP2A6TTRALDH1A1
SCHEMBL21975632 0.83 AHR (0.53) AHRCYP1A2CYP2A6TTR
SCHEMBL2287187 0.83 AHR (1.00) AHRCYP1A2CYP2A6TTRNR4A2
SCHEMBL21339985 0.83 AHR (0.53) AHRCYP1A2CYP2A6TTRALDH1A1

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
CN-113502066-A Preparation method and forming equipment of anticorrosive heat-insulating material 安徽鼎元新材料有限公司 2021-10-15 CN claimed
CN-113502066-A Preparation method and forming equipment of anticorrosive heat-insulating material 安徽鼎元新材料有限公司 2021-10-15 CN disclosed
CN-113502066-A Preparation method and forming equipment of anticorrosive heat-insulating material 安徽鼎元新材料有限公司 2021-10-15 CN disclosed
CN-113387719-A Multilayer-structure anti-corrosion thermal insulation material and preparation method thereof 安徽鼎元新材料有限公司 2021-09-14 CN disclosed