SCHEMBL13347519

SCHEMBL13347519

CC(C)n1c(=O)nc(-c2ccc(C(C)(C)C)cc2)c2cc([N+](=O)[O-])ccc21

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 18/20 0.67
▸ MEN1 O00255 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ NPBWR1 P48145 1/20 0.47

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
SCHEMBL13347118 0.87 CASR (0.68) CASRMEN1KMT2A
SCHEMBL11606905 0.86 CASR (0.61) CASRMEN1KMT2A
SCHEMBL13347132 0.80 CASR (1.00) CASR
SCHEMBL13347537 0.76 CASR (0.74) CASR
SCHEMBL11862638 0.73 L3MBTL1 (0.51) CASRMEN1KMT2ANPBWR1
SCHEMBL11547536 0.72 L3MBTL1 (0.50) CASRMEN1KMT2ANPBWR1
SCHEMBL11607181 0.71 CASR (0.63) CASR
SCHEMBL11784648 0.71 MAPT (0.46) CASRMEN1KMT2A
SCHEMBL11606364 0.71 L3MBTL1 (0.67) MEN1KMT2A
SCHEMBL1149958 0.69 MEN1 (1.00) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8476286-B2 for promoting the release of parathyroid hormone, e.g. for preventing or treating bone conditions which are associated with increased calcium depletion or resorption or in which stimulation of bone formation and calcium fixation in the bone is desirable NOVARTIS AG (CH) 2013-07-02 — — US disclosed
US-8476286-B2 for promoting the release of parathyroid hormone, e.g. for preventing or treating bone conditions which are associated with increased calcium depletion or resorption or in which stimulation of bone formation and calcium fixation in the bone is desirable NOVARTIS AG (CH) 2013-07-02 — — US disclosed
EP-2191832-A1 QUINAZOLINE DERIVATIVES WHICH PROMOTE THE RELEASE OF PARATHYROID HORMONE Novartis AG (CH) 2010-06-02 — — EP disclosed
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