SCHEMBL3204458

SCHEMBL3204458

NC[C@@H]1OC(c2ccccc2)O[C@H]1[C@H]1OC(c2ccccc2)O[C@@H]1CN

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HTR2C P28335 9/20 0.38
HTR2B P41595 8/20 0.38
HTR2A P28223 6/20 0.38
MAOB P27338 2/20 0.38
CYP2C19 P33261 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
DRD1 P21728 3/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
HSD17B10 Q99714 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
SCHEMBL22577266 0.90 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3HTR2CHTR2B
SCHEMBL4398458 0.81 SLC5A2 (0.40) SLC6A2SLC6A4SLC6A3HTR2CHTR2B
SCHEMBL4398460 0.81 SLC5A2 (0.40) SLC6A2SLC6A4SLC6A3HTR2CHTR2B
SCHEMBL12230287 0.80 MEN1 (0.35) MAOBCYP2C19MEN1KMT2A
SCHEMBL19772551 0.80 MEN1 (0.35) MAOBCYP2C19MEN1KMT2A
SCHEMBL14416580 0.80 MEN1 (0.35) MAOBCYP2C19MEN1KMT2A
SCHEMBL12253202 0.80 MEN1 (0.35) MAOBCYP2C19MEN1KMT2A
SCHEMBL13297303 0.80 MEN1 (0.35) MAOBCYP2C19MEN1KMT2A
SCHEMBL7154382 0.80 SLC5A2 (0.41) CYP2C19MEN1KMT2ACYP3A4CYP2D6
SCHEMBL14272007 0.80 MEN1 (0.35) MAOBCYP2C19MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7674839-B2 Methods for the production of polymer carrier materials based on carbon hydrate-bis(meth)acryl-amides TECHNISCHE UNIVERSITAT (AT) 2010-03-09 US disclosed
US-20080300383-A1 Methods for the Production of Polymer Carrier Materials Based on Carbon Hydrate-Bis(Meth)Acryl-Amides TECHNISCHE UNIVERSITAT WIEN (AT) 2008-12-04 US 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-20080300383-A1 Methods for the Production of Polymer Carrier Materials Based on Carbon Hydrate-Bis(Meth)Acryl-Amides ACR, PAM, MLN SLC6A2 1167/4885SLC6A4 243/4885SLC6A3 852/4885

“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.