SCHEMBL20149122

SCHEMBL20149122

CSC1CC(=O)N(CCC(=O)NCCC(C)C)C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.42
▸ PSMB5 P28074 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.39
▸ HDAC3 O15379 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC7 Q8WUI4 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC10 Q969S8 1/20 0.39
▸ HDAC11 Q96DB2 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ HDAC9 Q9UKV0 1/20 0.39
▸ HDAC5 Q9UQL6 1/20 0.39
▸ NAMPT P43490 2/20 0.39
▸ PKM P14618 1/20 0.37
▸ POLB P06746 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37

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
SCHEMBL16579861 0.91 HDAC3 (0.46) LMNAPSMB5HDAC3HDAC4HDAC1
SCHEMBL18081560 0.89 ALDH1A1 (0.37) HSD17B10HDAC3HDAC4HDAC1HDAC7
SCHEMBL19543592 0.88 LMNA (0.41) LMNAPSMB5HSD17B10HDAC3HDAC4
SCHEMBL14984422 0.87 HDAC3 (0.40) LMNAHSD17B10HDAC3HDAC4HDAC1
SCHEMBL23900960 0.87 HDAC3 (0.36) LMNAHSD17B10HDAC3HDAC4HDAC1
SCHEMBL12107731 0.87 HDAC3 (0.36) LMNAHSD17B10HDAC3HDAC4HDAC1
SCHEMBL2607944 0.86 ALDH1A1 (0.40) LMNAHSD17B10HDAC3HDAC4HDAC1
SCHEMBL14984432 0.86 ALDH1A1 (0.40) HSD17B10HDAC3HDAC4HDAC1HDAC7
SCHEMBL14544509 0.85 FOLH1 (0.40) LMNAPSMB5HSD17B10HDAC3HDAC4
SCHEMBL16328730 0.85 ALDH1A1 (0.39) HSD17B10HDAC3HDAC4HDAC1HDAC7

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-20180134717-A1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF SPIROGEN LIMITED (GB) 2018-05-17 — — 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-20180134717-A1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF HDAC10, PBDC1, PDCD10 LMNA 2456/4885PSMB5 2590/4885HSD17B10 853/4885

“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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