SCHEMBL15769147

SCHEMBL15769147

Cc1ccc(COc2ccn(-c3ccc4c5c(oc4c3)CCCN(C(=O)OC(C)(C)C)C5)c(=O)c2)cn1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 18/20 0.50
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA4 P22748 2/20 0.40
CA5A P35218 2/20 0.40
CA7 P43166 2/20 0.40
CA5B Q9Y2D0 2/20 0.40

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
SCHEMBL15769124 0.96 MCHR1 (0.50) MCHR1CA12CA1CA2CA4
SCHEMBL15768804 0.91 MCHR1 (0.57) MCHR1CA12CA1CA2CA4
SCHEMBL15781339 0.91 MCHR1 (0.51) MCHR1CA12CA1CA2CA4
SCHEMBL15769070 0.90 MCHR1 (0.52) MCHR1
SCHEMBL15769032 0.89 MCHR1 (0.54) MCHR1
SCHEMBL15769339 0.86 MCHR1 (0.55) MCHR1CA12CA1CA2CA4
SCHEMBL15769063 0.86 MCHR1 (0.53) MCHR1
SCHEMBL12949695 0.86 MCHR1 (0.66) MCHR1
SCHEMBL15769159 0.86 MCHR1 (0.58) MCHR1
SCHEMBL15769138 0.85 MCHR1 (0.51) MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140163012-A1 PYRIDO-/AZEPINO-BENZOFURAN AND PYRIDO-/AZEPINO-BENZOTHIOPHENE MCH-1 ANTAGONISTS, METHODS OF MAKING, AND USE THEREOF ALBANY MOLECULAR RESEARCH, INC. (US) 2014-06-12 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-20140163012-A1 PYRIDO-/AZEPINO-BENZOFURAN AND PYRIDO-/AZEPINO-BENZOTHIOPHENE MCH-1 ANTAGONISTS, METHODS OF MAKING, AND USE THEREOF MCHR1, MCHR2, TAAR1 MCHR1 1/4885CA12 4817/4885CA1 4703/4885

“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.