SCHEMBL16467124

SCHEMBL16467124

Cc1cc(N)cnc1N1CCC(C(C)(C)O)CC1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 5/20 0.51
PIK3CA P42336 2/20 0.43
MTOR P42345 2/20 0.43
CYP11B2 P19099 1/20 0.41
OPRK1 P41145 1/20 0.40
TRPV1 Q8NER1 1/20 0.37
PIK3CD O00329 1/20 0.36
HPGDS O60760 1/20 0.35
ATR Q13535 2/20 0.35
ATRIP Q8WXE1 1/20 0.35
ABL1 P00519 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
SCHEMBL25199994 0.84 TRPV1 (0.42) PDE10APIK3CAMTOROPRK1TRPV1
SCHEMBL30336490 0.84 TRPV1 (0.42) PDE10APIK3CAMTOROPRK1TRPV1
SCHEMBL16467029 0.83 PIK3CA (0.51) PDE10APIK3CAMTOROPRK1TRPV1
SCHEMBL23623176 0.82 OPRK1 (0.43) PIK3CAMTOROPRK1TRPV1
SCHEMBL23625673 0.81 KMT2A (0.44) OPRK1TRPV1
SCHEMBL23623617 0.77 PIK3CA (0.46) PDE10APIK3CAMTOROPRK1TRPV1
SCHEMBL14784205 0.77 ALDH1A1 (0.43) OPRK1TRPV1
SCHEMBL14782147 0.77 ALDH1A1 (0.47) OPRK1TRPV1
SCHEMBL3549179 0.75 FFAR4 (0.43) PIK3CAMTOROPRK1
SCHEMBL3538620 0.75 NEK2 (0.52) OPRK1

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
EP-2837627-B1 AMIDOPYRIDINE DERIVATIVE, AND USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2017-01-18 EP disclosed
US-9527859-B2 Amidopyridine derivative and use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2016-12-27 US disclosed
US-20150065715-A1 AMIDOPYRIDINE DERIVATIVE AND USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-03-05 US disclosed
EP-2837627-A1 AMIDOPYRIDINE DERIVATIVE, AND USE THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2015-02-18 EP 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-20150065715-A1 AMIDOPYRIDINE DERIVATIVE AND USE THEREOF IL5, IL2, IL4 PDE10A 1504/4885PIK3CA 3797/4885MTOR 3325/4885

“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.