SCHEMBL12435664

SCHEMBL12435664

CCCN(CCC)CCCN1CCNCC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 2/20 0.46
SIGMAR1 Q99720 4/20 0.45
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GNAO1 P09471 5/20 0.41
GNAI3 P08754 4/20 0.41
GNAI1 P63096 4/20 0.41
SOD3 P08294 2/20 0.36
HRH2 P25021 2/20 0.36
HRH1 P35367 2/20 0.36
HRH3 Q9Y5N1 1/20 0.36
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35

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
SCHEMBL23812330 0.95 SIGMAR1 (0.42) CXCR4SIGMAR1POLBSMN1; SMN2GNAO1
SCHEMBL972101 0.88 POLB (0.45) CXCR4SIGMAR1POLBSMN1; SMN2GNAO1
SCHEMBL24278278 0.86 POLB (0.44) CXCR4SIGMAR1POLBSMN1; SMN2GNAO1
SCHEMBL21120435 0.86 CXCR4 (0.47) CXCR4SIGMAR1POLBSMN1; SMN2GNAO1
SCHEMBL24277879 0.86 POLB (0.44) CXCR4SIGMAR1POLBSMN1; SMN2GNAO1
SCHEMBL151844 0.86 CXCR4 (0.47) CXCR4SIGMAR1POLBSMN1; SMN2GNAO1
SCHEMBL7994696 0.85 SIGMAR1 (0.49) CXCR4SIGMAR1POLBSMN1; SMN2GNAO1
SCHEMBL25733961 0.84 SIGMAR1 (0.43) CXCR4SIGMAR1GNAO1GNAI3GNAI1
SCHEMBL11510277 0.82 GNAO1 (0.44) CXCR4SIGMAR1GNAO1GNAI3GNAI1
SCHEMBL19032598 0.81 GNAO1 (0.46) CXCR4SIGMAR1POLBSMN1; SMN2GNAO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104046246-B The chemical-mechanical planarization of tungsten-containing substrate 气体产品与化学公司 2016-06-15 CN claimed
US-20140273458-A1 Chemical Mechanical Planarization for Tungsten-Containing Substrates AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-18 US claimed
EP-2779217-A2 Chemical mechanical planarization for tungsten-containing substrates AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-17 EP claimed
CN-104046246-A Chemical Mechanical Planarization for Tungsten-Containing Substrates AIR PROD & CHEM 2014-09-17 CN claimed
CN-104046246-B The chemical-mechanical planarization of tungsten-containing substrate 气体产品与化学公司 2016-06-15 CN disclosed
US-20140273458-A1 Chemical Mechanical Planarization for Tungsten-Containing Substrates AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-18 US disclosed
EP-2779217-A2 Chemical mechanical planarization for tungsten-containing substrates AIR PRODUCTS AND CHEMICALS, INC. (US) 2014-09-17 EP disclosed
CN-104046246-A Chemical Mechanical Planarization for Tungsten-Containing Substrates AIR PROD & CHEM 2014-09-17 CN disclosed
US-20110178053-A1 AZACARBOLINE DERIVATIVES, PREPARATION METHOD THEREOF AND THERAPEUTIC USE OF SAME SANOFI-AVENTIS (FR) 2011-07-21 US disclosed
US-20110178053-A1 AZACARBOLINE DERIVATIVES, PREPARATION METHOD THEREOF AND THERAPEUTIC USE OF SAME SANOFI-AVENTIS (FR) 2011-07-21 US disclosed
WO-2009150381-A2 AZACARBOLINE DERIVATIVES, PREPARATION METHOD THEREOF AND THERAPEUTIC USE OF SAME SANOFI-AVENTIS (FR) 2009-12-17 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-20110178053-A1 AZACARBOLINE DERIVATIVES, PREPARATION METHOD THEREOF AND THERAPEUTIC USE OF SAME AOC3, CBR3, IDH3B CXCR4 334/4885SIGMAR1 292/4885POLB 1576/4885

“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.