SCHEMBL21774003

SCHEMBL21774003

COc1ccc(C2CC(=O)C(=CN(C)C)C(=O)C2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP1LC3B Q9GZQ8 7/20 0.70
ALDH1A1 P00352 6/20 0.48
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MAPK1 P28482 2/20 0.48
MAPT P10636 4/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
HPGD P15428 3/20 0.43
KDM4E B2RXH2 2/20 0.43
LDHA P00338 1/20 0.43
LDHB P07195 1/20 0.43
USP2 O75604 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALOX15 P16050 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
SCHEMBL1779869 0.83 MAP1LC3B (1.00) MAP1LC3BALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL21795162 0.83 ALDH1A1 (0.51) MAP1LC3BALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL21821985 0.81 MAP1LC3B (0.74) MAP1LC3BALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL1780581 0.81 MAP1LC3B (1.00) MAP1LC3BALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL21821964 0.81 MAP1LC3B (0.71) MAP1LC3BALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL1780317 0.81 MAP1LC3B (1.00) MAP1LC3BALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL21821945 0.80 MAP1LC3B (0.63) MAP1LC3BALDH1A1KMT2ASMN1; SMN2NPC1
SCHEMBL21821722 0.78 MAP1LC3B (0.71) MAP1LC3BALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL21822054 0.77 MAP1LC3B (0.68) MAP1LC3BALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL29582044 0.77 MAP1LC3B (0.68) MAP1LC3BALDH1A1KMT2AMEN1SMN1; SMN2

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 9 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
US-20200069609-A1 METHOD FOR COVALENT BOND MODIFYING MAMMALIAN ATG8 HOMOLOGUE Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2020-03-05 US disclosed
US-20200069609-A1 METHOD FOR COVALENT BOND MODIFYING MAMMALIAN ATG8 HOMOLOGUE Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2020-03-05 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 (3 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 MAP1LC3B 15/4885ALDH1A1 4264/4885KMT2A 3378/4885
US-20200069609-A1 METHOD FOR COVALENT BOND MODIFYING MAMMALIAN ATG8 HOMOLOGUE ATG7, ATG4A, MLST8 MAP1LC3B 19/4885ALDH1A1 4094/4885KMT2A 1235/4885
US-20200190066-A1 COMPOUND USED AS AUTOPHAGY REGULATOR, AND PREPARATION METHOD THEREFOR AND USES THEREOF ATG7, SQSTM1, BECN1 MAP1LC3B 15/4885ALDH1A1 4264/4885KMT2A 3378/4885

“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.