SCHEMBL103877

SCHEMBL103877

CCCCN(N=O)C(=O)CCC

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA9 Q16790 2/20 0.38
KDM5A P29375 8/20 0.36
KDM4C Q9H3R0 7/20 0.36
CES2 O00748 2/20 0.36
CES1 P23141 2/20 0.36
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP8 P22894 1/20 0.35
TP53 P04637 1/20 0.35
PHF8 Q9UPP1 3/20 0.34
KDM4A O75164 1/20 0.34
AKR1B1 P15121 1/20 0.33

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
SCHEMBL102978 0.87 ALDH1A1 (0.38) ALDH1A1CA12CA9KDM5AKDM4C
SCHEMBL103820 0.85 CA12 (0.39) ALDH1A1CA12CA1CA9KDM5A
SCHEMBL103879 0.83 ALDH1A1 (0.50) ALDH1A1CA1KDM5AKDM4CCES2
SCHEMBL29882148 0.82 CYP1A2 (0.46) ALDH1A1KDM5AKDM4C
SCHEMBL103666 0.80 CES2 (0.38) ALDH1A1CES2CES1TP53
SCHEMBL103667 0.78 CA12 (0.40) ALDH1A1CA12CA1CA9CES2
SCHEMBL3502037 0.77 CA1 (0.39) ALDH1A1CA12CA1CA9CES2
SCHEMBL31462921 0.76 CA12 (0.35) ALDH1A1CA12CA1CA9MMP1
SCHEMBL3446371 0.73 MMP1 (0.56) ALDH1A1CA12CA1CA9KDM5A
SCHEMBL11161106 0.71 EPHX2 (0.50) ALDH1A1CA12CA1CA9KDM5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250362603-A1 PHOTORESIST UNDERLAYER MATERIALS AND ASSOCIATED METHODS TAIWAN SEMICONDUCTOR MFG CO LTD (TW) 2025-11-27 US disclosed
US-20250085631-A1 PHOTORESIST UNDERLAYER MATERIALS AND ASSOCIATED METHODS TAIWAN SEMICONDUCTOR MANUFACTURING COMPANY, LTD. (TW) 2025-03-13 US disclosed
CN-117070844-A Control method for liquid separation of NbC in niobium microalloyed medium-carbon non-quenched and tempered steel 中天钢铁集团有限公司 2023-11-17 CN disclosed
CN-116705146-A Multi-view enzyme function prediction method taking molecular structure and sequence mining into consideration 江南大学 2023-09-05 CN disclosed
CN-114974773-A Cubic gadolinium-based double perovskite magnetic refrigeration material and preparation method thereof 杭州电子科技大学 2022-08-30 CN disclosed
CN-109679868-A A kind of microorganism nitrosation inhibitor and preparation method thereof 天津农学院 2019-04-26 CN disclosed
US-8728442-B2 Method of controlling the growth of microorganisms by a composition containing isolated or in vitro synthesized nitrosoamides BAYER CROPSCIENCE LP (US) 2014-05-20 US disclosed
US-8728442-B2 Method of controlling the growth of microorganisms by a composition containing isolated or in vitro synthesized nitrosoamides BAYER CROPSCIENCE LP (US) 2014-05-20 US disclosed
US-20120058058-A1 COMPOUNDS DERIVED FROM MUSCODOR FUNGI AGRAQUEST, INC. (US) 2012-03-08 US disclosed
US-20120058058-A1 COMPOUNDS DERIVED FROM MUSCODOR FUNGI AGRAQUEST, INC. (US) 2012-03-08 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-20120058058-A1 COMPOUNDS DERIVED FROM MUSCODOR FUNGI SPOUT1, ERG28, DDT ALDH1A1 1190/4885CA12 4498/4885CA1 3779/4885

“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.