SCHEMBL691872

SCHEMBL691872

[CH2]C/C=C/C(/C=C/CCCCC)CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
CYP3A4 P08684 1/20 0.46
PTGS1 P23219 1/20 0.40
PPARG P37231 1/20 0.40
OPRK1 P41145 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
MAPT P10636 4/20 0.40
SPHK2 Q9NRA0 4/20 0.40
SPHK1 Q9NYA1 4/20 0.40
CETP P11597 3/20 0.40
MAPK1 P28482 3/20 0.40
CYP2D6 P10635 3/20 0.40
GMNN O75496 2/20 0.40
LMNA P02545 2/20 0.40
GLA P06280 2/20 0.40
POLB P06746 2/20 0.40
THRB P10828 2/20 0.40
CXCR5 P32302 2/20 0.40
CCR6 P51684 2/20 0.40

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
SCHEMBL691873 1.00 MEN1 (0.46) MEN1KMT2ACYP3A4PTGS1PPARG
SCHEMBL693426 0.88 MEN1 (0.34) MEN1KMT2ACYP3A4PTGS1PPARG
SCHEMBL10897482 0.82 ABCG2 (0.49) MEN1KMT2ACYP3A4PTGS1PPARG
SCHEMBL10897479 0.82 ABCG2 (0.49) MEN1KMT2ACYP3A4PTGS1PPARG
SCHEMBL2839828 0.78 MEN1 (0.52) MEN1KMT2ACYP3A4PTGS1PPARG
SCHEMBL9080744 0.78 MEN1 (0.47) MEN1KMT2ACYP3A4PTGS1PPARG
SCHEMBL28921995 0.76 MEN1 (0.50) MEN1KMT2ACYP3A4PTGS1PPARG
SCHEMBL78592 0.75
SCHEMBL78593 0.75
SCHEMBL873608 0.75

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 70 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160303243-A1 ANIONIC CONJUGATES OF GLYCOSYLATED BACTERIAL METABOLITE GLYCAN BIOSCIENCES LLC (US) 2016-10-20 US disclosed
US-9346845-B2 Anionic conjugates of glycosylated bacterial metabolite GLYCAN BIOSCIENCES LLC (US) 2016-05-24 US disclosed
US-20140323422-A1 Anionic Conjugates of Glycosylated Bacterial Metabolite Glycosynnovations Pty Ltd (AU) 2014-10-30 US disclosed
US-8791245-B2 Anionic conjugates of glycosylated bacterial metabolite Glycan Bioscience LLC (US) 2014-07-29 US disclosed
EP-2421877-A1 ANIONIC CONJUGATES OF GLYCOSYLATED BACTERIAL METABOLITE Glycan Biosciences Pty Ltd (AU) 2012-02-29 EP disclosed
US-20110190233-A1 ANIONIC CONJUGATES OF GLYCOSYLATED BACTERIAL METABOLITE GLYCAN BIOSCIENCES PTY LTD (AU) 2011-08-04 US disclosed
WO-2010037179-A1 ANIONIC CONJUGATES OF GLYCOSYLATED BACTERIAL METABOLITE GLYCAN BIOSCIENCES PTY LTD (AU) 2010-04-08 WO disclosed
US-7205333-B2 Therapy for influenza virus; inhaler BIOTA SCIENTIFIC MANAGEMENT PTY. LTD. (AU) 2007-04-17 US disclosed
US-7101909-B2 Compound of a ligand of 2-methoxy methylester-6-fluoronaphthalene, an aryl ligand and a linker; each ligand domain capable of binding to a Ca++ channel THERAVANCE, INC. (US) 2006-09-05 US disclosed
US-7067620-B2 Antibacterial agents THERAVANCE, INC. (US) 2006-06-27 US disclosed
WO-1999064045-A1 NOVEL THERAPEUTIC AGENTS FOR MEMBRANE TRANSPORTERS ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed
WO-1999064050-A1 NOVEL POTASSIUM CHANNEL DRUGS AND THEIR USES ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed
WO-1999063984-A1 NOVEL SODIUM CHANNEL DRUGS AND USES ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed
WO-1999063992-A1 NOVEL CALCIUM CHANNEL DRUGS AND USES ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed
WO-1999063930-A2 NOVEL ANGIOTENSIN RECEPTOR MODULATORS AND THEIR USES ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed
WO-1999064051-A1 NOVEL ANTIBACTERIAL COMPOUNDS ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed
WO-1999064040-A1 NOVEL POLYENE MACROLIDE COMPOUNDS AND USES ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed
WO-1999051565-A9 NOVEL LOCAL ANESTHETIC COMPOUNDS AND USES ADVANCED MEDICINE INC (US) 1999-12-02 WO disclosed
WO-1999051565-A1 NOVEL LOCAL ANESTHETIC COMPOUNDS AND USES ADVANCED MEDICINE, INC. (US) 1999-10-14 WO disclosed
WO-1999042476-A1 NOVEL ANTIBACTERIAL AGENTS ADVANCED MEDICINE, INC. (US) 1999-08-26 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 (3 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-20110190233-A1 ANIONIC CONJUGATES OF GLYCOSYLATED BACTERIAL METABOLITE GNE, CD44, FUT5 MEN1 1514/4885KMT2A 2624/4885CYP3A4 2423/4885
US-20160303243-A1 ANIONIC CONJUGATES OF GLYCOSYLATED BACTERIAL METABOLITE GNE, CD44, FUT5 MEN1 1514/4885KMT2A 2624/4885CYP3A4 2423/4885
US-20140323422-A1 Anionic Conjugates of Glycosylated Bacterial Metabolite GNE, CD44, FUT5 MEN1 1514/4885KMT2A 2624/4885CYP3A4 2423/4885

“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.