SCHEMBL6019410

SCHEMBL6019410

CCCCCCCCOC(=O)Nc1cc(C(C)(C)C)c(O)cc1C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.44
ESR1 P03372 1/20 0.44
AKR1C4 P17516 1/20 0.44
AKR1C3 P42330 1/20 0.44
AKR1C2 P52895 1/20 0.44
AKR1C1 Q04828 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.43
ALDH1A1 P00352 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GAA P10253 1/20 0.42
XBP1 P17861 1/20 0.42
ATM Q13315 1/20 0.42

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
SCHEMBL8956367 1.00 EPHX1 (0.44) EPHX1ESR1AKR1C4AKR1C3AKR1C2
SCHEMBL10583663 0.80 ESR1 (0.48) EPHX1ESR1AKR1C4AKR1C3AKR1C2
SCHEMBL6750845 0.80 NR5A2 (0.48) EPHX1ESR1AKR1C4AKR1C3AKR1C2
SCHEMBL11803015 0.79 ALDH1A1 (0.51) EPHX1ESR1AKR1C4AKR1C3AKR1C2
SCHEMBL45414 0.79 ALDH1A1 (0.51) EPHX1ESR1AKR1C4AKR1C3AKR1C2
SCHEMBL2750401 0.77 TSHR (0.54) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL3688694 0.75 ESR1 (0.45) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL4355643 0.75 SMN1; SMN2 (0.51) EPHX1ESR1AKR1C4AKR1C3AKR1C2
SCHEMBL11816562 0.74 ESR1 (0.44) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL10749478 0.73 GAA (0.46) ESR1AKR1C4AKR1C3AKR1C2AKR1C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2328965-B1 FLAME RETARDANT COMPOSITIONS WITH POLYMERIC DISPERSING AGENTS BASF SE (DE) 2013-03-06 EP disclosed
US-20060173107-A1 Graftable hindered amine light stabilizers CIBA SPECIALTY CHEMICALS CORP. 2006-08-03 US disclosed
US-4716185-A Curable mixtures based on diglycidyl compounds and metal complex compounds CIBA-GEIGY CORPORATION (US) 1987-12-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060173107-A1 Graftable hindered amine light stabilizers IDO1, MAOA, TPH1 EPHX1 1057/4885ESR1 2745/4885AKR1C4 1629/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.