SCHEMBL30819486

SCHEMBL30819486

CCN(CCc1cccc(OC)c1)CCN1CCCC1

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.73
HRH3 Q9Y5N1 1/20 0.69
SLC6A4 P31645 3/20 0.57
SLC6A3 Q01959 3/20 0.57
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
LTA4H P09960 1/20 0.52
SLC6A2 P23975 1/20 0.50

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
SCHEMBL2044710 1.00 SIGMAR1 (0.73) SIGMAR1HRH3SLC6A4SLC6A3MEN1
SCHEMBL30819491 0.84 SLC6A3 (0.73) SIGMAR1HRH3SLC6A4SLC6A3LTA4H
SCHEMBL10669091 0.82 HRH3 (1.00) SIGMAR1HRH3SLC6A4LTA4H
SCHEMBL5271881 0.82 AOC3 (0.66) SIGMAR1MEN1KMT2A
SCHEMBL17294993 0.81 HRH3 (0.97) SIGMAR1HRH3SLC6A4LTA4H
SCHEMBL22813625 0.80 HRH3 (0.83) SIGMAR1HRH3SLC6A4SLC6A3LTA4H
Hydrochloric Acid SCHEMBL10352286 0.78 HRH3 (0.78) SIGMAR1HRH3SLC6A4SLC6A3KMT2A
SCHEMBL467014 0.75 SIGMAR1 (1.00) SIGMAR1SLC6A4SLC6A3
SCHEMBL11655881 0.75 AOC3 (0.64) SIGMAR1
SCHEMBL5708997 0.74 HRH3 (0.72) SIGMAR1HRH3KMT2ALTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240132484-A1 BROAD SPECTRUM ANTIVIRAL COMPOUNDS TARGETING THE SKI COMPLEX UNIVERSITY OF MARYLAND, BALTIMORE 2024-04-25 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-20240132484-A1 BROAD SPECTRUM ANTIVIRAL COMPOUNDS TARGETING THE SKI COMPLEX EIF2AK2, MAVS, IRF3 SIGMAR1 3739/4885HRH3 4492/4885SLC6A4 4031/4885

“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.