SCHEMBL5493230

SCHEMBL5493230

NC1(C(=O)O)CCC(NCc2ccc3ccccc3c2)CC1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.50
GRM2 Q14416 1/20 0.49
SIGMAR1 Q99720 2/20 0.42
CCR3 P51677 1/20 0.42
MCHR1 Q99705 1/20 0.42
METAP2 P50579 1/20 0.42
METAP1 P53582 1/20 0.42
FFAR1 O14842 1/20 0.41
KDM4E B2RXH2 1/20 0.41
EPHX1 P07099 1/20 0.41

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
SCHEMBL5497326 0.85 OPRM1 (0.54) DRD4GRM2EPHX1
SCHEMBL695325 0.79 MEN1 (0.56) DRD4CCR3
Hydrochloric Acid SCHEMBL2807810 0.78 MEN1 (0.59) DRD4CCR3
SCHEMBL5493941 0.78 GRM2 (0.52) GRM2SIGMAR1KDM4EEPHX1
SCHEMBL15760101 0.75 HRH3 (0.59) DRD4CCR3METAP2METAP1
Trifluoroacetic Acid SCHEMBL5040989 0.73 DRD4 (0.48) DRD4SIGMAR1CCR3FFAR1
SCHEMBL3644107 0.73 OPRM1 (0.52) DRD4
SCHEMBL375103 0.73 DRD4 (0.46) DRD4CCR3
SCHEMBL1007347 0.73 SLC6A4 (0.56) DRD4CCR3
Hydrochloric Acid SCHEMBL6186358 0.72 SLC6A4 (0.55) DRD4CCR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7262163-B2 Short amphipathic peptides with activity against bacteria and intracellular pathogens BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2007-08-28 US claimed
US-20040059088-A1 Short amphipathic peptides with activity against bacteria and intracellular pathogens MCLAUGHLIN MARK L (US) 2004-03-25 US claimed
US-6566334-B1 For therapy of bacterial infection BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE 2003-05-20 US claimed

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-20040059088-A1 Short amphipathic peptides with activity against bacteria and intracellular pathogens VIP, MDK, HM13 DRD4 1156/4885GRM2 4555/4885SIGMAR1 2129/4885

“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.