SCHEMBL23930671

SCHEMBL23930671

CCOC(=O)C(=O)CCCC(=O)OC

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.60
FAAH O00519 2/20 0.50
CYP1A2 P05177 1/20 0.44
GAA P10253 2/20 0.43
MGAM O43451 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GLA P06280 1/20 0.39
OXER1 Q8TDS5 1/20 0.38
POLB P06746 1/20 0.38
SMYD3 Q9H7B4 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
SCHEMBL25761571 0.96 FAAH (0.54) TSHRFAAHCYP1A2GAAMGAM
SCHEMBL3007115 0.88 TSHR (0.56) TSHRFAAHGAAMGAMSI
SCHEMBL15842189 0.88 CYP1A2 (0.57) TSHRFAAHCYP1A2GAAMGAM
SCHEMBL18101453 0.87 FAAH (0.60) TSHRFAAHCYP1A2GAAMGAM
SCHEMBL11484524 0.83 FAAH (0.58) TSHRFAAHCYP1A2GAAMGAM
SCHEMBL1980139 0.83 TSHR (0.71) TSHRCYP1A2GAAMGAMSI
SCHEMBL280333 0.83 TSHR (0.71) TSHRGAAMGAMSIMGAM2
Dimethyl Succinate SCHEMBL20529591 0.81 TSHR (0.65) TSHRCYP1A2GAAMGAMSI
SCHEMBL10704882 0.81 FAAH (0.69) TSHRFAAHCYP1A2GAAMGAM
SCHEMBL1300141 0.79 FAAH (0.53) TSHRFAAHALDH1A1MEN1KMT2A

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
US-20230203008-A1 3-AZABICYCLOALKYL DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME LG CHEM, LTD. (KR) 2023-06-29 US disclosed
US-20230203008-A1 3-AZABICYCLOALKYL DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME LG CHEM, LTD. (KR) 2023-06-29 US disclosed
US-20230203008-A1 3-AZABICYCLOALKYL DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME LG CHEM, LTD. (KR) 2023-06-29 US disclosed
EP-4134366-A1 3-AZABICYCLOALKYL DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Lg Chem, Ltd. (KR) 2023-02-15 EP disclosed
WO-2021215765-A1 3-AZABICYCLOALKYL DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME 주식회사 엘지화학 (KR) 2021-10-28 WO 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-20230203008-A1 3-AZABICYCLOALKYL DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, ADCY1, ADCY7 TSHR 1706/4885FAAH 623/4885CYP1A2 69/4885

“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.