SCHEMBL18717218

SCHEMBL18717218

CCC(C)(C)CCCCOC(=O)CCN1CCC(CCCC2CCN(CCC(=O)OCCCCC(C)(C)CC)CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 6/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ CHRM1 P11229 2/20 0.36
▸ CHRM2 P08172 1/20 0.36
▸ CHRM4 P08173 1/20 0.36
▸ HTR1A P08908 1/20 0.36
▸ CHRM5 P08912 1/20 0.36
▸ ADRA2A P08913 1/20 0.36
▸ DRD2 P14416 1/20 0.36
▸ ADRA2B P18089 1/20 0.36
▸ CHRM3 P20309 1/20 0.36
▸ DRD4 P21917 1/20 0.36
▸ ADRA1D P25100 1/20 0.36
▸ ADRA1A P35348 1/20 0.36
▸ HRH1 P35367 1/20 0.36
▸ ADRA1B P35368 1/20 0.36
▸ FKBP1A P62942 2/20 0.35
▸ NAAA Q02083 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34

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
SCHEMBL15138014 0.93 SMN1; SMN2 (0.35) HRH3SMN1; SMN2CHRM1CHRM2CHRM4
SCHEMBL10036916 0.86 CHRM1 (0.44) HRH3SMN1; SMN2CHRM1CHRM2CHRM4
SCHEMBL13510860 0.85 SMN1; SMN2 (0.40) SMN1; SMN2CHRM1CHRM2CHRM4HTR1A
SCHEMBL15315851 0.85 HRH1 (0.44) HRH3CHRM1CHRM2CHRM4HTR1A
SCHEMBL13670291 0.85 NAAA (0.45) CHRM1CHRM2CHRM4HTR1ACHRM5
SCHEMBL10036917 0.84 HRH1 (0.45) HRH3SMN1; SMN2CHRM1CHRM2CHRM4
SCHEMBL19036251 0.83 SMN1; SMN2 (0.40) HRH3SMN1; SMN2CHRM1CHRM2CHRM4
SCHEMBL420320 0.83 CHRM1 (0.46) HRH3SMN1; SMN2CHRM1CHRM2CHRM4
SCHEMBL19036161 0.83 HRH1 (0.41) HRH3SMN1; SMN2CHRM1CHRM2CHRM4
SCHEMBL12650304 0.82 SMN1; SMN2 (0.36) HRH3SMN1; SMN2CHRM1CHRM2CHRM4

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-20170258738-A1 Multilayer Compositions, Coated Devices And Use Thereof DEPARTMENT OF DEFENSE 2017-09-14 — — US disclosed
US-9610252-B2 Multilayer compositions, coated devices and use thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-04-04 — — 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-20170258738-A1 Multilayer Compositions, Coated Devices And Use Thereof EPHA3, EPHA2, BDNF HRH3 4823/4885SMN1; SMN2 493/4885CHRM1 1197/4885

“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.

Send feedback