SCHEMBL6137154

SCHEMBL6137154

O=C(NCO)C1CC2C=CC1C2

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.65
LMNA P02545 1/20 0.65
ALDH1A1 P00352 5/20 0.43
KMT2A Q03164 2/20 0.43
THRB P10828 1/20 0.43
EPHX2 P34913 4/20 0.42
POLB P06746 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
APEX1 P27695 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
ESR2 Q92731 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HPGD P15428 1/20 0.41
ESR1 P03372 1/20 0.39
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 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
SCHEMBL11064769 0.86 KDM4E (0.61) KDM4ELMNAALDH1A1KMT2ATHRB
SCHEMBL11064771 0.86 KDM4E (0.61) KDM4ELMNAALDH1A1KMT2ATHRB
SCHEMBL5349832 0.84 KDM4E (0.62) KDM4ELMNAALDH1A1KMT2ATHRB
SCHEMBL13233317 0.82 KDM4E (0.56) KDM4ELMNAALDH1A1KMT2ATHRB
SCHEMBL9924679 0.81 KDM4E (0.59) KDM4ELMNAALDH1A1KMT2ATHRB
SCHEMBL10124090 0.81 KDM4E (0.59) KDM4ELMNAALDH1A1KMT2ATHRB
SCHEMBL14392991 0.81 KDM4E (0.59) KDM4ELMNAALDH1A1KMT2ATHRB
SCHEMBL24403596 0.80 KDM4E (0.57) KDM4ELMNAALDH1A1KMT2ATHRB
SCHEMBL9802843 0.80 LMNA (0.57) KDM4ELMNAALDH1A1KMT2ATHRB
SCHEMBL14489328 0.80 KDM4E (0.57) KDM4ELMNAALDH1A1KMT2ATHRB

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-10781175-B2 Solid supports and phosphoramidite building blocks for oligonucleotide conjugates AM CHEMICALS LLC (US) 2020-09-22 US disclosed
US-20180016232-A1 SOLID SUPPORTS AND PHOSPHORAMIDITE BUILDING BLOCKS FOR OLIGONUCLEOTIDE CONJUGATES AM CHEMICALS LLC (US) 2018-01-18 US disclosed
WO-2018013999-A1 NON-NUCLEOSIDIC SOLID SUPPORTS AND PHOSPHORAMIDITE BUILDING BLOCKS FOR OLIGONUCLEOTIDE SYNTHESIS AM CHEMICALS LLC (US) 2018-01-18 WO disclosed
EP-1446115-A4 CYANOALKYLAMINO DERIVATIVES AS PROTEASE INHIBITORS MERCK FROSST CANADA INC (CA) 2005-02-02 EP disclosed
EP-1446115-A2 CYANOALKYLAMINO DERIVATIVES AS PROTEASE INHIBITORS Merck Frosst Canada & Co. (CA) 2004-08-18 EP disclosed
WO-2003041649-A2 CYANOALKYLAMINO DERIVATIVES AS PROTEASE INHIBITORS MERCK FROSST CANADA & CO. (CA) 2003-05-22 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 (2 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-10781175-B2 Solid supports and phosphoramidite building blocks for oligonucleotide conjugates NCL, PAICS, RTCB KDM4E 4024/4885LMNA 2437/4885ALDH1A1 4559/4885
US-20180016232-A1 SOLID SUPPORTS AND PHOSPHORAMIDITE BUILDING BLOCKS FOR OLIGONUCLEOTIDE CONJUGATES NCL, PAICS, RTCB KDM4E 4024/4885LMNA 2437/4885ALDH1A1 4559/4885

“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.