SCHEMBL21773997

SCHEMBL21773997

CCNC(=S)N1CCN(CCNC=C2C(=O)CC(c3ccccc3)CC2=O)CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ MAPT P10636 5/20 0.45
▸ LMNA P02545 3/20 0.45
▸ MAP1LC3B Q9GZQ8 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ GAA P10253 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RAB9A P51151 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL21821560 0.85 MAP1LC3B (0.46) ALDH1A1MAPTLMNAMAP1LC3BHTT
SCHEMBL26530728 0.83 MEN1 (0.49) MAP1LC3BMEN1KMT2A
SCHEMBL21821980 0.83 MAPT (0.65) ALDH1A1MAPTLMNAMAP1LC3BL3MBTL1
SCHEMBL21821591 0.82 SLC18A3 (0.50) ALDH1A1MAP1LC3BGAAMEN1KMT2A
SCHEMBL21773995 0.82 ALDH1A1 (0.46) ALDH1A1MAPTLMNAMAP1LC3BHTT
SCHEMBL21821703 0.82 MEN1 (0.42) ALDH1A1MAPTLMNAMAP1LC3BHTT
SCHEMBL21821755 0.82 MAP1LC3B (0.44) ALDH1A1MAPTLMNAMAP1LC3BHTT
SCHEMBL21773998 0.82 KMT2A (0.47) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL24899431 0.81 MAP1LC3B (0.55) ALDH1A1MAPTLMNAMAP1LC3BL3MBTL1
SCHEMBL21821987 0.80 CYP2C9 (0.42) ALDH1A1KDM4ELMNAMAP1LC3BL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20200069609-A1 METHOD FOR COVALENT BOND MODIFYING MAMMALIAN ATG8 HOMOLOGUE ATG7, ATG4A, MLST8 ALDH1A1 4094/4885KDM4E 1558/4885MAPT 2766/4885

“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.

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