SCHEMBL5872641

SCHEMBL5872641

CCCCCOC(=O)C(O[C]=O)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HCAR2 Q8TDS4 2/20 0.42
EPHX1 P07099 1/20 0.41
ATM Q13315 1/20 0.40
TSHR P16473 4/20 0.40
MAPK1 P28482 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HPGD P15428 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
RAD52 P43351 1/20 0.38
ABCB1 P08183 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
SCHEMBL4203836 0.95 ALDH1A1 (0.48) NAAAALDH1A1HCAR2EPHX1ATM
SCHEMBL9013100 0.85 NAAA (0.43) NAAAALDH1A1HCAR2EPHX1ATM
SCHEMBL6161479 0.81 NAAA (0.48) NAAAALDH1A1HCAR2EPHX1TSHR
SCHEMBL9453048 0.81 NAAA (0.48) NAAAALDH1A1HCAR2EPHX1TSHR
SCHEMBL9460966 0.80 NAAA (0.41) NAAAALDH1A1HCAR2EPHX1ATM
SCHEMBL8402246 0.78 NAAA (0.42) NAAAALDH1A1HCAR2EPHX1ATM
SCHEMBL3761727 0.77 NAAA (0.44) NAAAALDH1A1HCAR2EPHX1TSHR
SCHEMBL5143996 0.77 ALDH1A1 (0.47) NAAAALDH1A1HCAR2EPHX1ATM
SCHEMBL9586962 0.76 NAAA (0.43) NAAAALDH1A1HCAR2EPHX1TSHR
SCHEMBL7042625 0.76 NAAA (0.47) NAAAALDH1A1HCAR2EPHX1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7102019-B2 Cosmetic and pharmaceutical preparations comprising ascorbic acid derivatives BASF AKTIENGESELLSCHAFT (DE) 2006-09-05 US disclosed
US-20020034527-A1 Cosmetic and pharmaceutical preparations comprising ascorbic acid derivatives STREICHER HARALD (DE) 2002-03-21 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-20020034527-A1 Cosmetic and pharmaceutical preparations comprising ascorbic acid derivatives PROC, ALDH16A1, RCN1 NAAA 1364/4885ALDH1A1 14/4885HCAR2 462/4885

“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.