SCHEMBL15048894

SCHEMBL15048894

C1=C\[N]/C=C\N\C=C/1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL2024 0.83
SCHEMBL2384 0.71
SCHEMBL32690450 0.69
SCHEMBL31675861 0.67
SCHEMBL29993421 0.67
SCHEMBL128941 0.67
SCHEMBL6276848 0.67
SCHEMBL7637912 0.67
SCHEMBL22434925 0.67
SCHEMBL22993 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9468635-B2 Fused ring compound for use as mineralocorticoid receptor antagonist KBP BIOSCIENCES CO., LTD. (CN) 2016-10-18 US disclosed
US-9198902-B2 1,4-dihydropyridine-3,5-dicarboxylate derivatives and preparation and use thereof Xuanzhu Pharma Co., Ltd. (CN) 2015-12-01 US disclosed
US-20150126501-A1 Fused Ring Compound For Use As Mineralocorticoid Receptor Antagonist NOVO NORDISK A/S (DK) 2015-05-07 US disclosed
US-8946279-B2 Fused ring compound for use as mineralocorticoid receptor antagonist KBP BIOSCIENCES CO., LTD. (CN) 2015-02-03 US disclosed
EP-2703398-A1 1,4-DIHYDROPYRIDINE -3,5-DICARBOXYLATE DERIVATIVES, PREPARATION METHODS AND USES THEREOF Xuanzhu Pharma Co., Ltd. (CN) 2014-03-05 EP disclosed
US-20140045896-A1 1,4-dihydropyridine-3,5-dicarboxylate Derivatives And Preparation And Use Thereof Xuanzhu Pharma Co., Ltd. (CN) 2014-02-13 US disclosed
US-20130289029-A1 Fused Ring Compound For Use As Mineralocorticoid Receptor Antagonist NOVO NORDISK A/S (DK) 2013-10-31 US disclosed
EP-2607363-A1 FUSED RING COMPOUND FOR USE AS MINERALOCORTICOID RECEPTOR ANTAGONIST KBP Biosciences Co., Ltd. (CN) 2013-06-26 EP disclosed