SCHEMBL21822046

SCHEMBL21822046

COc1ccc(C2CC(=O)C(=CNCCN3CCN(CCO)CC3)C(=O)C2)c2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DRD3 P35462 2/20 0.38
▸ FAAH O00519 1/20 0.38
▸ SIGMAR1 Q99720 1/20 0.38
▸ MAP1LC3B Q9GZQ8 1/20 0.38
▸ DRD4 P21917 3/20 0.37
▸ HTR2A P28223 1/20 0.36
▸ DRD2 P14416 2/20 0.36
▸ DRD1 P21728 1/20 0.36
▸ TP53 P04637 1/20 0.36

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
SCHEMBL29582419 1.00 DRD3 (0.38) DRD3FAAHSIGMAR1MAP1LC3BDRD4
SCHEMBL22111710 0.84 MAP1LC3B (0.40) MAP1LC3B
SCHEMBL21821569 0.84 TP53 (0.49) DRD4HTR2ADRD2TP53
SCHEMBL21821610 0.82 TP53 (0.38) DRD3SIGMAR1MAP1LC3BDRD4DRD2
SCHEMBL29581966 0.82 HRH3 (0.40) DRD3FAAHMAP1LC3BDRD4HTR2A
SCHEMBL21822005 0.82 HRH3 (0.40) DRD3FAAHMAP1LC3BDRD4HTR2A
SCHEMBL22111676 0.81 MEN1 (0.39) DRD3HTR2ADRD2
SCHEMBL21821934 0.81 L3MBTL1 (0.41) MAP1LC3BDRD4HTR2ADRD2TP53
SCHEMBL21821710 0.81 SLC18A3 (0.39) DRD3
SCHEMBL21822040 0.80 LMNA (0.40) DRD3SIGMAR1MAP1LC3BDRD4DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3632903-B1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF WIGEN BIOMEDICINE TECH SHANGHAI CO LTD (CN) 2023-10-11 — — EP disclosed
EP-3632903-B1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF WIGEN BIOMEDICINE TECH SHANGHAI CO LTD (CN) 2023-10-11 — — EP disclosed
US-11319303-B2 Compound used as autophagy regulator, and preparation method therefor and uses thereof Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2022-05-03 — — US disclosed
US-11319303-B2 Compound used as autophagy regulator, and preparation method therefor and uses thereof Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2022-05-03 — — US disclosed
US-20200190066-A1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2020-06-18 — — US disclosed
US-20200190066-A1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2020-06-18 — — US disclosed
EP-3632903-A1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF Wigen Biomedicine Technology (Shanghai) Co., Ltd. (CN) 2020-04-08 — — 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 (2 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-11319303-B2 Compound used as autophagy regulator, and preparation method therefor and uses thereof ATG7, SQSTM1, BECN1 DRD3 4600/4885FAAH 3885/4885SIGMAR1 3139/4885
US-20200190066-A1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF ATG7, SQSTM1, BECN1 DRD3 4600/4885FAAH 3885/4885SIGMAR1 3139/4885

“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.

Send feedback