SCHEMBL9951664

SCHEMBL9951664

CNCCC(=O)O.CNCCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 4/20 0.47
LMNA P02545 4/20 0.47
ALKBH5 Q6P6C2 1/20 0.47
SUCNR1 Q9BXA5 1/20 0.47
KDM4E B2RXH2 3/20 0.46
KDM5C P41229 3/20 0.46
PHF8 Q9UPP1 3/20 0.46
KDM2A Q9Y2K7 3/20 0.46
KDM4A O75164 1/20 0.45
KDM4C Q9H3R0 1/20 0.45
FFAR3 O14843 1/20 0.45
HDAC3 O15379 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
SLC15A2 Q16348 1/20 0.43
ECE1 P42892 1/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
KDM6B O15054 2/20 0.42
ADRA1A P35348 1/20 0.41

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
SCHEMBL21400 1.00
Hydrochloric Acid SCHEMBL28601855 0.97
SCHEMBL5880626 0.97
SCHEMBL10886785 0.97
Hydrochloric Acid SCHEMBL792974 0.97
Oxalic Acid SCHEMBL2750704 0.94 KDM4A (0.42) EGLN1LMNAALKBH5SUCNR1KDM4E
Nitrous Acid SCHEMBL21196900 0.89 KDM4A (0.40) EGLN1LMNAALKBH5SUCNR1KDM4E
Beta-Alanine SCHEMBL1892332 0.87 LMNA (0.44) EGLN1LMNAALKBH5SUCNR1KDM4E
Tetradecane SCHEMBL11867100 0.85 GPR84 (0.62) LMNASLC22A6TSHRAKR1B1PLA2G2A
Trifluoroacetic Acid SCHEMBL27903019 0.85 KDM4A (0.38) EGLN1LMNAALKBH5SUCNR1KDM4E

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-20120165409-A1 WRINKLE-IMPROVING AGENT SHISEIDO COMPANY, LTD. (JP) 2012-06-28 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-20120165409-A1 WRINKLE-IMPROVING AGENT AAAS, GLA, COL14A1 EGLN1 2303/4885LMNA 105/4885ALKBH5 3871/4885

“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.