SCHEMBL19214722

SCHEMBL19214722

CCN(CC)CCNCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
PAOX Q6QHF9 1/20 0.42
ALDH1A1 P00352 7/20 0.41
KMT2A Q03164 3/20 0.39
LMNA P02545 3/20 0.39
SLC22A2 O15244 1/20 0.39
SLC22A1 O15245 1/20 0.39
TSHR P16473 1/20 0.39
ACHE P22303 1/20 0.39
MAPK1 P28482 1/20 0.39
CYP2C19 P33261 1/20 0.39
KDM5A P29375 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
TOP2A P11388 2/20 0.37
ALDH2 P05091 1/20 0.37
MEN1 O00255 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HPGD P15428 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
Hydrochloric Acid SCHEMBL17220603 0.98 KDM4E (0.46) KDM4EPAOXALDH1A1KMT2ALMNA
Hydrochloric Acid SCHEMBL29124192 0.98 KDM4E (0.46) KDM4EPAOXALDH1A1KMT2ALMNA
SCHEMBL13261102 0.90 TDP1 (0.43) KDM4EPAOXALDH1A1KMT2ALMNA
SCHEMBL13177612 0.87 TDP1 (0.50) KDM4EPAOXALDH1A1KMT2ALMNA
SCHEMBL13261104 0.87 KDM4E (0.48) KDM4EPAOXALDH1A1KMT2ALMNA
SCHEMBL700015 0.87 KDM4E (0.48) KDM4EPAOXALDH1A1KMT2ALMNA
SCHEMBL10663592 0.85 PAOX (0.49) KDM4EPAOXALDH1A1KMT2ALMNA
Bicarbonate SCHEMBL30077224 0.84 PAOX (0.50) KDM4EPAOXALDH1A1KMT2ALMNA
SCHEMBL8604932 0.82 LMNA (0.36) KDM4ELMNATSHRCYP2C19KDM5A
SCHEMBL10724209 0.81 FFAR3 (0.39) PAOXALDH1A1KMT2ALMNATSHR

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-20170227690-A1 NEAR INFRARED RAY ABSORBENT COMPOSITION, NEAR INFRARED RAY CUT FILTER, SOLID IMAGE PICKUP ELEMENT, AND CAMERA MODULE FUJIFILM CORPORATION (JP) 2017-08-10 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-20170227690-A1 NEAR INFRARED RAY ABSORBENT COMPOSITION, NEAR INFRARED RAY CUT FILTER, SOLID IMAGE PICKUP ELEMENT, AND CAMERA MODULE C9, SET, CRY1 KDM4E 2067/4885PAOX 2524/4885ALDH1A1 2313/4885

“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.