SCHEMBL18507035

SCHEMBL18507035

O=C(NCCCN1CCC(c2ccccc2)CC1)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 3/20 0.65
SLC6A2 P23975 3/20 0.56
SLC6A4 P31645 3/20 0.56
ADRA1D P25100 1/20 0.54
ADRA1A P35348 1/20 0.54
ADRA1B P35368 1/20 0.54
CCR3 P51677 2/20 0.54
HRH3 Q9Y5N1 1/20 0.54
MCHR2 Q969V1 1/20 0.53
MCHR1 Q99705 1/20 0.53
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
DRD2 P14416 1/20 0.52
TMEM97 Q5BJF2 2/20 0.52

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
SCHEMBL18502055 0.93 HRH3 (0.66) CHRM4SLC6A2SLC6A4HRH3SMN1; SMN2
SCHEMBL7477521 0.89 CHRM4 (0.59) CHRM4SLC6A2SLC6A4CCR3HRH3
SCHEMBL17194340 0.87 OPRM1 (0.66) CHRM4SLC6A2SLC6A4CCR3HRH3
SCHEMBL17194307 0.86 CHRM4 (0.64) CHRM4SLC6A2SLC6A4CCR3MCHR2
SCHEMBL17194187 0.86 CHRM4 (0.64) CHRM4SLC6A2SLC6A4CCR3MCHR2
SCHEMBL14430677 0.85 CHRM4 (0.62) CHRM4HRH3MCHR2MCHR1KDM4E
SCHEMBL18506936 0.85 SLC6A2 (0.78) CHRM4SLC6A2SLC6A4CCR3SMN1; SMN2
SCHEMBL17194299 0.85 CHRM4 (0.63) CHRM4SLC6A2SLC6A4CCR3MCHR2
SCHEMBL17194188 0.85 L3MBTL3 (0.67) CHRM4SLC6A2SLC6A4CCR3HRH3
SCHEMBL18502056 0.85 CHRM4 (0.63) CHRM4SLC6A2SLC6A4CCR3MCHR2

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
EP-3131890-B1 COMPOUNDS FOR TREATING VIRAL INFECTIONS PASTEUR INSTITUT KOREA (KR) 2019-04-24 EP disclosed
US-9809602-B2 Compounds for treating viral infections INSTITUT PASTEUR KOREA (KR) 2017-11-07 US disclosed
US-20170044181-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS INSTITUT PASTEUR KOREA (KR) 2017-02-16 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-20170044181-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS HAVCR2, MAVS, EIF2AK2 CHRM4 4630/4885SLC6A2 3168/4885SLC6A4 3863/4885

“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.