SCHEMBL7203340

SCHEMBL7203340

C#CCCC#C.CCOC(CC)OC(C)=O

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL202380 0.87 ALDH1A1 (0.40) ALDH1A1MEN1MAPTKMT2ALMNA
SCHEMBL7202517 0.80 LMNA (0.39) ALDH1A1MEN1USP2TP53CYP3A4
SCHEMBL7709890 0.74 ALDH1A1 (0.40) ALDH1A1MEN1MAPTKMT2ALMNA
SCHEMBL7203351 0.74 GRIK1 (0.33)
SCHEMBL315270 0.73 TSHR (0.48) ALDH1A1MEN1MAPTKMT2ALMNA
SCHEMBL7704110 0.72 TSHR (0.39) ALDH1A1MAPTLMNAHSD17B10TSHR
SCHEMBL10352883 0.72 TSHR (0.39) ALDH1A1MAPTMAPK1LMNAHSD17B10
SCHEMBL11101510 0.72 TSHR (0.39) ALDH1A1MAPTKMT2ALMNAHSD17B10
SCHEMBL1471664 0.72 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ALMNAHSD17B10
SCHEMBL3030080 0.71 TSHR (0.37) ALDH1A1CYP3A4MAPTKMT2ALMNA

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-6607868-B2 Dipropargyl acetamide HYNIX SEMICONDUCTOR INC. (KR) 2003-08-19 US disclosed
US-20020012879-A1 Novel photoresist monomers, polymers thereof, and photoresist compositions containing the same HYNIX SEMICONDUCTOR INC. (KR) 2002-01-31 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-20020012879-A1 Novel photoresist monomers, polymers thereof, and photoresist compositions containing the same CDH1, DDAH1, DPEP1 ALDH1A1 67/4885MEN1 2541/4885USP2 2582/4885

“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.