SCHEMBL13403154

SCHEMBL13403154

CCN(C)c1nccc(C)n1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.36
ACACB O00763 1/20 0.36
CRHR1 P34998 2/20 0.36
KMT2A Q03164 1/20 0.35
HCRTR1 O43613 8/20 0.35
HCRTR2 O43614 8/20 0.35
HRH3 Q9Y5N1 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33

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
SCHEMBL24798325 0.84 ACACB (0.38) ALOX15ACACBCRHR1HCRTR1HCRTR2
SCHEMBL13806015 0.81 TAAR1 (0.39) ALOX15ACACBCRHR1KMT2ANPSR1
SCHEMBL13806027 0.80 HRH3 (0.51) HCRTR1HCRTR2HRH3MTNR1AMTNR1B
SCHEMBL1586782 0.78 DYRK1A (0.42)
SCHEMBL4259756 0.78 TAAR1 (0.40) ACACBKMT2AHRH3MTNR1AMTNR1B
SCHEMBL10144707 0.78 HRH3 (0.41) ACACBKMT2AHRH3MTNR1AMTNR1B
SCHEMBL12870911 0.76 CRHR1 (0.46) CRHR1HCRTR1HCRTR2
SCHEMBL13384561 0.75 ACACB (0.39) ACACBHCRTR1HCRTR2HRH3MTNR1A
SCHEMBL13806050 0.75 CRHR1 (0.39) ALOX15CRHR1KMT2AHCRTR1HCRTR2
SCHEMBL13403110 0.73 CRHR1 (0.40) ALOX15CRHR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8940771-B2 Organic compounds NOVARTIS AG (CH) 2015-01-27 US disclosed
US-8940771-B2 Organic compounds NOVARTIS AG (CH) 2015-01-27 US disclosed
US-7696210-B2 Gonadotropin releasing hormone receptor antagonists WYETH (US) 2010-04-13 US disclosed
US-20090163469-A1 Organic Compounds NOVARTIS AG 2009-06-25 US disclosed
US-20090163469-A1 Organic Compounds NOVARTIS AG 2009-06-25 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-20090163469-A1 Organic Compounds PIK3C3, PIK3CA, PIK3CD ALOX15 2664/4885ACACB 1200/4885CRHR1 4774/4885

“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.