SCHEMBL21382932

SCHEMBL21382932

C#CCCCCC([CH2])CCCCC#C

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP2 O75604 4/20 0.43
CYP3A4 P08684 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL2120878 0.79
SCHEMBL1454256 0.77
SCHEMBL2119938 0.77 USP2 (0.44) USP2CYP3A4SMN1; SMN2MAPTCYP1A2
SCHEMBL8960459 0.75 USP2 (0.38) USP2CYP3A4SMN1; SMN2MAPTCYP1A2
SCHEMBL1062616 0.74
SCHEMBL10081318 0.72 USP2 (0.65) USP2CYP3A4SMN1; SMN2MAPTCYP1A2
SCHEMBL1313662 0.72
SCHEMBL1760701 0.71 MAPT (0.55) USP2CYP3A4SMN1; SMN2MAPTCYP1A2
SCHEMBL8382273 0.71 MAPT (0.55) USP2CYP3A4SMN1; SMN2MAPTCYP1A2
SCHEMBL2520528 0.71 MAPT (0.55) USP2CYP3A4SMN1; SMN2MAPTCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3768693-A1 OLIGOSACCHARIDE C-GLYCOSIDE DERIVATIVES Okinawa Institute of Science and Technology School Corporation (JP) 2021-01-27 EP disclosed
US-20210017211-A1 OLIGOSACCHARIDE C-GLYCOSIDE DERIVATIVES OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2021-01-21 US disclosed
WO-2019182087-A1 OLIGOSACCHARIDE C-GLYCOSIDE DERIVATIVES OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2019-09-26 WO 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-20210017211-A1 OLIGOSACCHARIDE C-GLYCOSIDE DERIVATIVES OSTC, FUT6, FUT5 USP2 3423/4885CYP3A4 1350/4885SMN1; SMN2 3638/4885

“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.