SCHEMBL598176

SCHEMBL598176

CC#CCCC(O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.52
LMNA P02545 1/20 0.50
KDM4E B2RXH2 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
AOC3 Q16853 5/20 0.43
KMT2A Q03164 1/20 0.42
GAA P10253 1/20 0.39
PABPC1 P11940 1/20 0.38
APOBEC3A P31941 1/20 0.38
EIF4H Q15056 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38

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
SCHEMBL29211109 0.82 RIPK1 (0.48) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL94698 0.80 LMNA (0.54) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL9066616 0.79 ALDH1A1 (0.50) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL3081755 0.76 RIPK1 (0.64) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL5185803 0.76 RIPK1 (0.64) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL27692795 0.76 RIPK1 (0.50) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL2496078 0.76 RIPK1 (0.50) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL2939704 0.76 RIPK1 (0.50) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL29860819 0.74 RIPK1 (0.61) RIPK1LMNAKDM4EL3MBTL1AOC3
SCHEMBL8710104 0.74 RIPK1 (0.61) RIPK1LMNAKDM4EL3MBTL1AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8115019-B2 Cis-2, 6-disubstituted tetrahydropyran derivatives and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-02-14 US disclosed
US-8115019-B2 Cis-2, 6-disubstituted tetrahydropyran derivatives and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-02-14 US disclosed
WO-2009104849-A1 CIS-2,6-DISUBSTITUTED TETRAHYDROPYRAN DERIVATIVES AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-08-27 WO disclosed
WO-2009104849-A1 CIS-2,6-DISUBSTITUTED TETRAHYDROPYRAN DERIVATIVES AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-08-27 WO disclosed
US-20090209770-A1 CIS-2, 6-DISUBSTITUTED TETRAHYDROPYRAN DERIVATIVES AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-08-20 US disclosed
US-20090209770-A1 CIS-2, 6-DISUBSTITUTED TETRAHYDROPYRAN DERIVATIVES AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-08-20 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-20090209770-A1 CIS-2, 6-DISUBSTITUTED TETRAHYDROPYRAN DERIVATIVES AND PREPARATION METHOD THEREOF TYMS, DHFR, FDPS RIPK1 4222/4885LMNA 3109/4885KDM4E 2503/4885

“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.