SCHEMBL26758333

SCHEMBL26758333

CC(=O)[C@H](CCCNC(N)=O)NC(=O)C(NC(=O)CCCC#Cc1cnc(S(C)(=O)=O)nc1)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NMT2 O60551 2/20 0.34
▸ NMT1 P30419 2/20 0.34
▸ HDAC3 O15379 1/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC7 Q8WUI4 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ HDAC10 Q969S8 1/20 0.33
▸ HDAC11 Q96DB2 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ HDAC9 Q9UKV0 1/20 0.33
▸ HDAC5 Q9UQL6 1/20 0.33
▸ NPY1R P25929 1/20 0.31
▸ NPY2R P49146 1/20 0.31
▸ NPY4R P50391 1/20 0.31
▸ NPY5R Q15761 1/20 0.31
▸ FURIN P09958 1/20 0.31

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
SCHEMBL26755869 1.00 NMT2 (0.34) NMT2NMT1HDAC3HDAC4HDAC1
SCHEMBL23193205 0.90 GLP1R (0.32) —
SCHEMBL27189813 0.87 HDAC3 (0.35) NMT2NMT1HDAC3HDAC4HDAC1
SCHEMBL22618780 0.87 NMT2 (0.37) NMT2NMT1HDAC3HDAC4HDAC1
SCHEMBL28454451 0.87 NMT2 (0.37) NMT2NMT1HDAC3HDAC4HDAC1
SCHEMBL26758249 0.85 HDAC3 (0.33) NMT2NMT1HDAC3HDAC4HDAC1
SCHEMBL23193206 0.85 HDAC3 (0.33) NMT2NMT1HDAC3HDAC4HDAC1
SCHEMBL22618769 0.83 HDAC3 (0.34) NMT2NMT1HDAC3HDAC4HDAC1
SCHEMBL24642860 0.80 CA2 (0.36) —
SCHEMBL31217911 0.80 MMP2 (0.31) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357259-A1 BIOACTIVE CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2023-11-09 — — 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-20230357259-A1 BIOACTIVE CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF DOCK11, PAICS, RHOA NMT2 773/4885NMT1 1073/4885HDAC3 3043/4885

“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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