SCHEMBL12997264

SCHEMBL12997264

CCCCC(N)CC1(C)OCCO1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.32
PLA2G2A P14555 1/20 0.32
OPRM1 P35372 2/20 0.31
CHRM2 P08172 1/20 0.30
HTR1A P08908 1/20 0.30
ADRA2A P08913 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
CHRM1 P11229 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
DRD3 P35462 1/20 0.30
SLC6A3 Q01959 1/20 0.30
KCNH2 Q12809 1/20 0.30
CYP2D6 P10635 1/20 0.30
S1PR2 O95136 5/20 0.30
S1PR1 P21453 5/20 0.30
S1PR3 Q99500 5/20 0.30
S1PR4 O95977 4/20 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
SCHEMBL12997291 0.81
Fluoride SCHEMBL1995827 0.71 OPRM1 (0.48) PLA2G1BPLA2G2AOPRM1S1PR2S1PR1
SCHEMBL12997262 0.70 ALDH1A1 (0.30)
SCHEMBL10824704 0.69 PLA2G1B (0.41) PLA2G1BPLA2G2AOPRM1S1PR2S1PR1
SCHEMBL272998 0.68 OPRM1 (0.50) PLA2G1BPLA2G2AOPRM1S1PR2S1PR1
SCHEMBL12997261 0.67
SCHEMBL10914883 0.67 OPRM1 (0.41) PLA2G1BPLA2G2AOPRM1SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL1997517 0.66 OPRM1 (0.48) PLA2G1BPLA2G2AOPRM1S1PR2S1PR1
Bromide SCHEMBL1993996 0.66 OPRM1 (0.48) PLA2G1BPLA2G2AOPRM1S1PR2S1PR1
SCHEMBL23211228 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130230898-A1 HYDROXYALKYL STARCH DERIVATIVES AND PROCESS FOR THEIR PREPARATION FRESENIUS KABI DEUTSCHLAND GMBH (DE) 2013-09-05 US disclosed
US-20130230898-A1 HYDROXYALKYL STARCH DERIVATIVES AND PROCESS FOR THEIR PREPARATION FRESENIUS KABI DEUTSCHLAND GMBH (DE) 2013-09-05 US disclosed
US-8404834-B2 Hydroxyalkyl starch derivatives and process for their preparation FRESENIUS KABI DEUTSCHLAND GMBH (DE) 2013-03-26 US disclosed
US-8404834-B2 Hydroxyalkyl starch derivatives and process for their preparation FRESENIUS KABI DEUTSCHLAND GMBH (DE) 2013-03-26 US disclosed
EP-2231711-B1 HYDROXYALKYL STARCH DERIVATIVES AND PROCESS FOR THEIR PREPARATION FRESENIUS KABI DE GMBH (DE) 2012-11-07 EP disclosed
US-20100305033-A1 HYDROXYALKYL STARCH DERIVATIVES AND PROCESS FOR THEIR PREPARATION FRESENIUS KABI DEUTSCHLAND GMBH (DE) 2010-12-02 US disclosed
US-20100305033-A1 HYDROXYALKYL STARCH DERIVATIVES AND PROCESS FOR THEIR PREPARATION FRESENIUS KABI DEUTSCHLAND GMBH (DE) 2010-12-02 US disclosed
WO-2009077154-A1 HYDROXYALKYL STARCH DERIVATIVES AND PROCESS FOR THEIR PREPARATION FRESENIUS KABI DEUTSCHLAND GMBH (DE) 2009-06-25 WO disclosed
EP-2070950-A1 Hydroxyalkyl starch derivatives and process for their preparation Fresenius Kabi Deutschland GmbH (DE) 2009-06-17 EP 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-20100305033-A1 HYDROXYALKYL STARCH DERIVATIVES AND PROCESS FOR THEIR PREPARATION HDHD5, KHK, SORD PLA2G1B 4142/4885PLA2G2A 4081/4885OPRM1 2772/4885

“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.