SCHEMBL13178479

SCHEMBL13178479

CCNCCCCN1CCCCC1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.56
CYP2C19 P33261 2/20 0.46
CYP1A2 P05177 2/20 0.46
SCN5A Q14524 2/20 0.45
CARM1 Q86X55 1/20 0.45
PRMT6 Q96LA8 1/20 0.45
PRMT8 Q9NR22 1/20 0.45
RAD52 P43351 1/20 0.43
MEN1 O00255 1/20 0.42
GLA P06280 1/20 0.42
KMT2A Q03164 1/20 0.42
TSHR P16473 1/20 0.41
MAPT P10636 1/20 0.41
HRH1 P35367 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM1A O60341 1/20 0.39

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
SCHEMBL7326006 0.98 HRH3 (0.60) HRH3CYP2C19CYP1A2SCN5ACARM1
SCHEMBL13766333 0.98 HRH3 (0.52) HRH3CYP2C19CYP1A2SCN5ACARM1
SCHEMBL13660804 0.96 HRH3 (0.52) HRH3CYP2C19CYP1A2SCN5ACARM1
SCHEMBL21727231 0.94 HRH3 (0.52) HRH3CYP2C19CYP1A2SCN5ACARM1
SCHEMBL9120834 0.94 HRH3 (0.52) HRH3CYP2C19CYP1A2SCN5ACARM1
SCHEMBL6733235 0.91 CARM1 (0.48) HRH3CYP2C19CYP1A2SCN5ACARM1
SCHEMBL13661321 0.90 HRH3 (0.48) HRH3CYP2C19CYP1A2SCN5ACARM1
SCHEMBL12612802 0.89 CYP2C19 (0.52) HRH3CYP2C19CYP1A2MEN1GLA
SCHEMBL16675490 0.87 HRH3 (0.47) HRH3CYP2C19CYP1A2SCN5ACARM1
SCHEMBL13160710 0.86 HRH3 (0.54) HRH3SCN5ACARM1PRMT6PRMT8

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-20170137409-A1 Amine Cationic Lipids and Uses Thereof NOVO NORDISK A/S (DK) 2017-05-18 US disclosed
US-9549983-B2 Amine cationic lipids and uses thereof DICERNA PHARMACEUTICALS, INC. (US) 2017-01-24 US disclosed
US-20100222319-A1 NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-09-02 US disclosed
WO-2009131246-A1 SORDARIN DERIVATIVES FOR PREVENTING OR TREATING INFECTIOUS DISEASES CAUSED BY PATHOGENIC MICROORGANISMS ASTELLAS PHARMA INC. (JP) 2009-10-29 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-20170137409-A1 Amine Cationic Lipids and Uses Thereof SGMS2, SLC43A1, SGMS1 HRH3 454/4885CYP2C19 4871/4885CYP1A2 4850/4885
US-20100222319-A1 NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF NNT, NAMPT, NQO1 HRH3 1334/4885CYP2C19 849/4885CYP1A2 1022/4885

“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.