SCHEMBL2196372

SCHEMBL2196372

O=[C]CC1CNCCN1CCO

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA4 P22748 2/20 0.33
CA9 Q16790 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MITF O75030 1/20 0.30
TAAR1 Q96RJ0 1/20 0.30

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
SCHEMBL9660605 0.85 TAAR1 (0.39) MITFTAAR1
SCHEMBL9661914 0.81 TAAR1 (0.41) TAAR1
SCHEMBL3834096 0.80 TDP1 (0.35) CA1CA2CA4CA9TDP1
SCHEMBL9660849 0.80 TAAR1 (0.41) TAAR1
SCHEMBL9660870 0.79 TAAR1 (0.32) TAAR1
SCHEMBL366506 0.79 CA1 (0.42) CA1CA2CA4CA9TDP1
SCHEMBL9660920 0.78 TAAR1 (0.40) TAAR1
SCHEMBL9658788 0.78 TAAR1 (0.40) TAAR1
SCHEMBL9660125 0.78 TAAR1 (0.40) TAAR1
SCHEMBL9660272 0.78 TAAR1 (0.40) TAAR1

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-7977455-B2 Analogues of GLP-1 IPSEN PHARMA, S.A.S. (FR) 2011-07-12 US disclosed
US-20090197802-A1 Analogues of GLP-1 SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES, S.A.S. (FR) 2009-08-06 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-20090197802-A1 Analogues of GLP-1 GLP1R, IAPP, GIPR CA1 3428/4885CA2 3330/4885CA4 3104/4885

“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.