SCHEMBL1801855

SCHEMBL1801855

CN(C)CCCC(=O)NO

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 5/20 0.56
HDAC3 O15379 4/20 0.56
HDAC2 Q92769 4/20 0.56
HDAC8 Q9BY41 4/20 0.56
HDAC6 Q9UBN7 3/20 0.56
HDAC5 Q9UQL6 2/20 0.56
HSP90AA1 P07900 1/20 0.52
DNM1 Q05193 2/20 0.48
HDAC4 P56524 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
PAOX Q6QHF9 1/20 0.42
PHF8 Q9UPP1 2/20 0.42
KDM2A Q9Y2K7 2/20 0.42
KDM4E B2RXH2 1/20 0.42
KDM6B O15054 1/20 0.42
KDM5C P41229 1/20 0.42
FOLH1 Q04609 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
SCHEMBL24218522 0.91 HDAC3 (0.65) HDAC1HDAC3HDAC2HDAC8HDAC6
SCHEMBL8170991 0.81 DNM1 (0.48) DNM1PAOXPHF8KDM2AKDM4A
SCHEMBL964918 0.79 CTSD (0.50) DNM1PAOXPHF8KDM2AKDM4E
SCHEMBL16293640 0.77 DNM1 (0.59) DNM1PAOXPHF8KDM2AKDM4A
SCHEMBL8773743 0.77 DNM1 (0.76) DNM1PAOXKDM4E
SCHEMBL29076197 0.77 DNM1 (0.46) DNM1PAOXPHF8KDM2AKDM4A
SCHEMBL11768749 0.76 HDAC1 (0.93) HDAC1HDAC3HDAC2HDAC8HDAC6
Glutarodihydroxamic Acid SCHEMBL11768782 0.76 HDAC1 (0.81) HDAC1HDAC3HDAC2HDAC8HDAC6
SCHEMBL7721282 0.76 MEN1 (0.57) DNM1PAOXPHF8KDM2AKDM4E
SCHEMBL26484642 0.74 DNM1 (0.52) DNM1PAOXPHF8KDM2AKDM4A

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-115151252-B Iron death inhibitor-diarylamine acetamides 维泰瑞隆有限公司 2024-08-27 CN disclosed
EP-4114375-A1 FERROPTOSIS INHIBITORS-DIARYLAMINE PARA-ACETAMIDES Sironax Ltd (KY) 2023-01-11 EP disclosed
US-7951972-B2 Human adam-10 inhibitors EXELIXIS, INC. (US) 2011-05-31 US disclosed
US-20090143386-A1 Human adam-10 inhibitors EXELIXIS, INC. 2009-06-04 US disclosed
US-7498358-B2 e.g. N1-hydroxy-N2-[(4-phenoxyphenyl)sulfonyl]-D-argininamide; metallopeptidase inhibitor; antiinflammation, anticarcinogenic, antidiabetic agent; angiogenesis inhibitor; atherosclerosis, stroke, ulcer, infertility, scleroderma, endometriosis, mesothelioma EXELIXIS, INC. (US) 2009-03-03 US disclosed
US-20050227973-A1 Human adam-10 inhibitors EXELIXIS, INC. 2005-10-13 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 (2 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-20050227973-A1 Human adam-10 inhibitors ADAM10, ADAM12, ADAM9 HDAC1 819/4885HDAC3 970/4885HDAC2 746/4885
US-20090143386-A1 Human adam-10 inhibitors ADAM10, ADAM12, CASP10 HDAC1 1103/4885HDAC3 1210/4885HDAC2 1035/4885

“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.