SCHEMBL21821837

SCHEMBL21821837

CN1CCN(c2ccc(C3CC(=O)C(=CNCCN4CCN(CCO)CC4)C(=O)C3)cc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 2/20 0.36
▸ DRD4 P21917 2/20 0.36
▸ HDAC4 P56524 1/20 0.36
▸ HDAC8 Q9BY41 5/20 0.35
▸ HDAC3 O15379 4/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ MAP1LC3B Q9GZQ8 1/20 0.35
▸ USP8 P40818 1/20 0.35
▸ CHKA P35790 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ KDM1A O60341 1/20 0.34

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
SCHEMBL21821739 0.90 MAP1LC3B (0.41) ALDH1A1MAP1LC3B
SCHEMBL21821814 0.86 MAP1LC3B (0.45) ALDH1A1MAP1LC3B
SCHEMBL21821647 0.85 GAA (0.40) DRD4
SCHEMBL21821781 0.85 ALDH1A1 (0.38) ALDH1A1MAP1LC3B
SCHEMBL21821754 0.84 MAP1LC3B (0.44) ALDH1A1MAP1LC3B
SCHEMBL26523495 0.84 MAP1LC3B (0.47) HDAC8ALDH1A1MAP1LC3BHDAC2HDAC6
SCHEMBL21821591 0.84 SLC18A3 (0.50) ALDH1A1MAP1LC3BKDM1A
SCHEMBL22111846 0.84 MAP1LC3B (0.41) ALDH1A1MAP1LC3BKDM1A
SCHEMBL26523519 0.83 ALDH1A1 (0.43) ALDH1A1MAP1LC3B
SCHEMBL26523529 0.83 ALDH1A1 (0.37) ALDH1A1MAP1LC3B

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 DRD2 4459/4885DRD4 4559/4885HDAC4 734/4885
US-20200190066-A1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF ATG7, SQSTM1, BECN1 DRD2 4459/4885DRD4 4559/4885HDAC4 734/4885

“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