SCHEMBL19865080

SCHEMBL19865080

CC1(C)CC(I)CC(C)(C)C1

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A1 O15245 1/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
LMNA P02545 1/20 0.31
ESR1 P03372 1/20 0.31
ADRB3 P13945 1/20 0.31
ACHE P22303 1/20 0.31
OPRK1 P41145 1/20 0.31
MTOR P42345 1/20 0.31
HTT P42858 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
NFKB1 P19838 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL18862469 0.80
SCHEMBL20879668 0.77 ALDH1A1 (0.30)
SCHEMBL18019388 0.77 ALDH1A1 (0.30)
SCHEMBL18473702 0.77 ALDH1A1 (0.30)
SCHEMBL24071527 0.75
SCHEMBL21316087 0.72
SCHEMBL4413629 0.69 ESR1 (0.45) ESR1CYP2D6
SCHEMBL7495865 0.69
SCHEMBL16748934 0.67
SCHEMBL887697 0.67 APLNR (0.33) ESR1

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
WO-2022261654-A1 OPTICALLY TRANSPARENT POLYIMIDE ZYMERGEN INC. (US) 2022-12-15 WO disclosed
US-11066506-B2 Polymer composition and coatings prepared from the same NIPSEA TECHNOLOGIES PTE LTD (SG) 2021-07-20 US disclosed
US-20200361974-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2020-11-19 US disclosed
EP-3203564-B1 GEL POLYMER ELECTROLYTE AND LITHIUM SECONDARY BATTERY COMPRISING SAME LG CHEMICAL LTD (KR) 2018-02-14 EP 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-20200361974-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES L1CAM, TRPM2, ORAI2 SLC22A1 3422/4885GRIN2D 1801/4885GRIN3B 1658/4885

“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.