SCHEMBL1377045

SCHEMBL1377045

CCCN(C)C(=O)CCOC

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
HPGD P15428 1/20 0.39
EPHX2 P34913 2/20 0.36
CNR1 P21554 2/20 0.36
DNM1 Q05193 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
BCHE P06276 3/20 0.33
ACHE P22303 3/20 0.33
KDM5A P29375 3/20 0.33
LMNA P02545 1/20 0.32
KDM4C Q9H3R0 1/20 0.32

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
SCHEMBL13133182 0.85 ALDH1A1 (0.50) ALDH1A1EPHX2CNR1DNM1BCHE
SCHEMBL1373497 0.83 ALDH1A1 (0.39) ALDH1A1HPGDEPHX2CNR1DNM1
SCHEMBL18232024 0.83 CHRM2 (0.38) ALDH1A1DNM1MEN1KMT2ABCHE
SCHEMBL1373081 0.83 ALDH1A1 (0.57) ALDH1A1HPGDLMNA
SCHEMBL1375496 0.83 LMNA (0.39) ALDH1A1CNR1MEN1KMT2ABCHE
SCHEMBL1373915 0.82 NR1I2 (0.36) ALDH1A1HPGDEPHX2CNR1DNM1
SCHEMBL19709756 0.81 ALDH1A1 (0.34) ALDH1A1MEN1KMT2A
SCHEMBL12209818 0.80 ALDH1A1 (0.42) ALDH1A1HPGDEPHX2CNR1KDM5A
SCHEMBL1375855 0.79 ALDH1A1 (0.48) ALDH1A1HPGDLMNA
SCHEMBL1376712 0.79 EPHX2 (0.33) ALDH1A1HPGDEPHX2CNR1DNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3728235-B1 SUBSTITUTED THIOPHENYLURACILS , THEIR SALTS AND USE OF SAID COMPOUNDS AS HERBICIDAL AGENTS SYNGENTA CROP PROTECTION AG (CH) 2022-02-09 EP disclosed
US-20150119604-A1 METHOD FOR PRODUCING BETA-ALKOXYPROPIONAMIDE IDEMITSU KOSAN CO., LTD. (JP) 2015-04-30 US disclosed
EP-2837619-A1 METHOD FOR PRODUCING BETA -ALKOXYPROPIONAMIDE Idemitsu Kosan Co., Ltd (JP) 2015-02-18 EP disclosed
US-8563495-B2 Resist remover composition and method for removing resist using same IDEMITSU KOSAN CO., LTD. (JP) 2013-10-22 US disclosed
US-20110287995-A1 RESIST REMOVER COMPOSITION AND METHOD FOR REMOVING RESIST USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2011-11-24 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-20150119604-A1 METHOD FOR PRODUCING BETA-ALKOXYPROPIONAMIDE HACL2, APEH, NAAA ALDH1A1 448/4885HPGD 1082/4885EPHX2 116/4885

“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.