SCHEMBL5178698

SCHEMBL5178698

NCCN1CCC(CN(CCO)CCO)CC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRMT3 O60678 1/20 0.42
CARM1 Q86X55 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
PRMT1 Q99873 1/20 0.42
PRMT8 Q9NR22 1/20 0.42
ALOX15 P16050 1/20 0.41
GNAI3 P08754 2/20 0.41
GNAO1 P09471 2/20 0.41
GNAI1 P63096 2/20 0.41
NCF1 P14598 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SLC18A3 Q16572 1/20 0.31
CHRM3 P20309 1/20 0.31
JAK2 O60674 1/20 0.30
JAK1 P23458 1/20 0.30
TYK2 P29597 1/20 0.30

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
SCHEMBL5177566 0.90 KEAP1 (0.39) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL5178776 0.88 CHRM1 (0.36) GNAI3GNAO1GNAI1CHRM3
SCHEMBL9824832 0.80 GNAO1 (0.45) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL5179307 0.78 ALOX15 (0.42) ALOX15GNAO1
SCHEMBL598481 0.77 ALOX15 (0.48) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL5178556 0.77 ALOX15 (0.38) ALOX15GNAI3GNAO1GNAI1
SCHEMBL5180446 0.77 CHRM1 (0.35) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL6783180 0.77 ALOX15 (0.52) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL5179281 0.76 ALOX15 (0.43) PRMT3CARM1PRMT6PRMT1PRMT8
SCHEMBL5177788 0.76 NCF1 (0.41) PRMT3CARM1PRMT6PRMT1PRMT8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0927174-B1 NEW AMINO ALCOHOL DERIVATIVES, PROCESS FOR THE PRODUCTION THEREOF AND MEDICAMENTS AND REAGENTS CONTAINING THESE COMPOUNDS MEDIGENE AG (DE) 2007-12-12 EP disclosed
US-7097854-B2 Amino alcohol derivatives, process for their production and pharmaceutical preparations and reagents containing these compounds MEDIGENE ONCOLOGY GMBH (DE) 2006-08-29 US disclosed
US-20030236266-A1 Amino alcohol derivatives, process for their production and pharmaceutical preparations and reagents containing these compounds ROCHE DIAGNOSTICS GMBH 2003-12-25 US disclosed
CN-1087293-C New amino alcohol derivatives, process for production thereof and medicaments and reagents containing these compounds ROHER DIAGNOSTIC EQUIPMENT AG (DE) 2002-07-10 CN disclosed
CN-1237161-A New amino alcohol derivatives, process for production thereof and medicaments and reagents containing these compounds ROHER DIAGNOSTIC EQUIPMENT AG (DE) 1999-12-01 CN 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-20030236266-A1 Amino alcohol derivatives, process for their production and pharmaceutical preparations and reagents containing these compounds ADH1C, ADH1A, ADH5 PRMT3 83/4885CARM1 96/4885PRMT6 72/4885

“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.