SCHEMBL28346778

SCHEMBL28346778

NCCCC[C@H](N)C(=O)OC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 6/20 0.61
▸ MEN1 O00255 1/20 0.57
▸ ABL1 P00519 1/20 0.57
▸ LMNA P02545 1/20 0.57
▸ PKM P14618 1/20 0.57
▸ IDE P14735 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ RIN1 Q13671 1/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ HLCS P50747 6/20 0.50
▸ CA12 O43570 5/20 0.46
▸ CA1 P00915 5/20 0.46
▸ CA2 P00918 5/20 0.46
▸ CA9 Q16790 5/20 0.46
▸ HPSE Q9Y251 1/20 0.44

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
SCHEMBL22190207 0.92 TDP1 (0.64) TDP1MEN1ABL1LMNAPKM
SCHEMBL28780247 0.90 TDP1 (0.61) TDP1MEN1ABL1LMNAPKM
SCHEMBL8392745 0.88 TDP1 (0.70) TDP1MEN1ABL1LMNAPKM
SCHEMBL8646594 0.88 TDP1 (0.64) TDP1MEN1ABL1LMNAPKM
SCHEMBL21768379 0.87 TDP1 (0.62) TDP1MEN1ABL1LMNAPKM
SCHEMBL28395847 0.86 TDP1 (0.61) TDP1MEN1ABL1LMNAPKM
SCHEMBL28601561 0.86 TDP1 (0.61) TDP1MEN1ABL1LMNAPKM
SCHEMBL28717516 0.86 TDP1 (0.61) TDP1MEN1ABL1LMNAPKM
SCHEMBL27481572 0.85 TDP1 (0.64) TDP1MEN1ABL1LMNAPKM
SCHEMBL29462121 0.85 TDP1 (0.62) TDP1MEN1ABL1LMNAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117062820-A Method for producing biotin, and L-lysine salt of biotin and method for producing same 株式会社德山 2023-11-14 — — CN claimed
CN-110536696-B PCSK9 vaccine based on novel peptides 载度思生命科学有限公司 2023-11-24 — — CN disclosed
CN-117062820-A Method for producing biotin, and L-lysine salt of biotin and method for producing same 株式会社德山 2023-11-14 — — CN disclosed
CN-113167796-A Methods for performing mass spectrometry on engineered cell compositions 朱诺治疗学股份有限公司 2021-07-23 — — CN disclosed
CN-112074738-A Heart failure detection method, instrument for heart failure detection, sandwich immunoassay, and combination of antibodies 共立制药股份有限公司 2020-12-11 — — CN disclosed
CN-110536696-A PCSK9 vaccine based on new peptide CADILA HEALTHCARE LTD 2019-12-03 — — CN disclosed
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