SCHEMBL5655837

SCHEMBL5655837

COc1ccccc1N1CCN(CCCN(C(=O)O)c2ccccc2OC)CC1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.63
HTR2A P28223 1/20 0.61
KDM4E B2RXH2 1/20 0.61
ALDH1A1 P00352 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
DRD3 P35462 4/20 0.59
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
HTR1A P08908 2/20 0.58
DRD4 P21917 1/20 0.58

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
SCHEMBL5656387 0.93 HTR1A (0.61) DRD2HTR2AKDM4EALDH1A1TDP1
SCHEMBL5654884 0.93 DRD2 (0.61) DRD2HTR2AKDM4EALDH1A1TDP1
SCHEMBL5655926 0.93 DRD2 (0.55) DRD2HTR2AKDM4EALDH1A1TDP1
SCHEMBL5654725 0.93 DRD2 (0.55) DRD2HTR2AKDM4EALDH1A1TDP1
SCHEMBL5655964 0.92 DRD2 (0.54) DRD2HTR2AKDM4EALDH1A1TDP1
SCHEMBL5657861 0.90 OPRM1 (0.55) DRD2HTR2AKDM4EALDH1A1TDP1
SCHEMBL5659495 0.87 OPRM1 (0.50) DRD2HTR2AKDM4EALDH1A1TDP1
SCHEMBL5666060 0.87 MEN1 (0.55) DRD2HTR2AKDM4EALDH1A1TDP1
SCHEMBL5656281 0.86 OPRM1 (0.52) DRD2HTR1ADRD4
SCHEMBL5657065 0.86 ALDH1A1 (0.51) DRD2HTR2AALDH1A1DRD3HTR1A

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-7238693-B2 Aryl carbamate derivatives, preparation and use thereof CEREP (FR) 2007-07-03 US disclosed
US-20040058933-A1 Aryl carbamate derivatives, preperation and use thereof CEREP (FR) 2004-03-25 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-20040058933-A1 Aryl carbamate derivatives, preperation and use thereof HTR4, HTR5A, HTR3C DRD2 73/4885HTR2A 14/4885KDM4E 512/4885

“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.