SCHEMBL5585308

SCHEMBL5585308

OCc1ncccc1OCCOC1CCCCO1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MET P08581 2/20 0.37
ALDH1A1 P00352 1/20 0.35
P2RX3 P56373 4/20 0.34
TGFBR1 P36897 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.32
IDO1 P14902 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
SCHEMBL3114026 0.82 KDM4C (0.46) KDM4CMEN1KMT2AL3MBTL1NPC1
SCHEMBL5585338 0.81 KDM4C (0.40) KDM4CMEN1KMT2AL3MBTL1NPC1
SCHEMBL12634794 0.81 KDM4C (0.47) KDM4CMEN1KMT2AL3MBTL1NPC1
SCHEMBL4988791 0.81 NPC1 (0.44) KDM4CMEN1KMT2AL3MBTL1NPC1
SCHEMBL5585743 0.80 KDM4C (0.39) KDM4CMEN1KMT2AL3MBTL1NPC1
SCHEMBL5585591 0.80 MEN1 (0.45) KDM4CMEN1KMT2AL3MBTL1NPC1
SCHEMBL1345450 0.76 KDM4C (0.49) KDM4CMEN1KMT2AL3MBTL1NPC1
SCHEMBL23835071 0.75 KDM4C (0.46) KDM4CMEN1KMT2AL3MBTL1NPC1
SCHEMBL6304992 0.75 KDM4C (0.46) KDM4CMEN1KMT2AL3MBTL1NPC1
SCHEMBL8340573 0.75 KDM4C (0.46) KDM4CMEN1KMT2AL3MBTL1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7226925-B2 Compounds, their use and preparation BIOVITRUM AB (SE) 2007-06-05 US disclosed
EP-1513831-A1 NOVEL COMPOUNDS, THEIR USE AND PREPARATION Biovitrum AB (SE) 2005-03-16 EP disclosed
US-20040029888-A1 Novel compounds, their use and preparation PROXIMAGEN NEUROSCIENCE PLC (GB) 2004-02-12 US disclosed
WO-2004000830-A1 NOVEL COMPOUNDS, THEIR USE AND PREPARATION BIOVITRUM AB (SE) 2003-12-31 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-20040029888-A1 Novel compounds, their use and preparation TPH1, TPH2, HTR1A KDM4C 3366/4885MEN1 582/4885KMT2A 4032/4885

“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.