SCHEMBL17087573

SCHEMBL17087573

C[C@H](CCCc1ncccn1)[C@@H](O)CC(N)=O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.33
HRH2 P25021 1/20 0.31

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
SCHEMBL18127457 0.83 HRH2 (0.47) NAAAHRH2
SCHEMBL18127483 0.80 HRH2 (0.46) NAAAHRH2
SCHEMBL18127459 0.78 MMP12 (0.40) NAAA
SCHEMBL18123839 0.78 ADORA3 (0.34) HRH2
SCHEMBL18127505 0.78 FAAH (0.30)
SCHEMBL17518395 0.78 CYP2C19 (0.32)
SCHEMBL6164386 0.77 NAAA (0.38) NAAA
SCHEMBL18127475 0.77 CYP1A2 (0.42) HRH2
SCHEMBL18123857 0.77 FDPS (0.41)
SCHEMBL18127484 0.77 HTT (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170007664-A1 CYCLIC DEPSIPEPTIDE COMPOUNDS AND THEIR USES CYPRALIS LIMITED (GB) 2017-01-12 US disclosed
US-20160289271-A1 Cyclosporins Modified on the MeBmt Sidechain by Heterocyclic Rings ALLERGAN, INC. 2016-10-06 US disclosed
US-9382295-B2 Cyclic depsipeptide compounds and their uses CYPRALIS LIMITED (GB) 2016-07-05 US disclosed
US-20150259386-A1 CYCLIC DEPSIPEPTIDE COMPOUNDS AND THEIR USES CYPRALIS LIMITED (GB) 2015-09-17 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 (3 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-20170007664-A1 CYCLIC DEPSIPEPTIDE COMPOUNDS AND THEIR USES FKBP14, FKBP1A, PIN1 NAAA 3272/4885HRH2 2966/4885
US-20160289271-A1 Cyclosporins Modified on the MeBmt Sidechain by Heterocyclic Rings CHP1, UACA, CRYAB NAAA 4657/4885HRH2 588/4885
US-20150259386-A1 CYCLIC DEPSIPEPTIDE COMPOUNDS AND THEIR USES FKBP14, FKBP1A, PIN1 NAAA 3272/4885HRH2 2966/4885

“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.