SCHEMBL4315969

SCHEMBL4315969

[c]1ccc2cn[c]nc2c1

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
SCHEMBL2640123 0.83
SCHEMBL3032 0.71 ALDH1A1 (0.44)
SCHEMBL449631 0.71
SCHEMBL156192 0.68 MAP4K4 (0.31)
SCHEMBL80966 0.67 EGFR (0.52)
SCHEMBL3834527 0.67
SCHEMBL9322559 0.66 ACHE (0.42)
SCHEMBL4755875 0.65
SCHEMBL2303882 0.65 CYP1A2 (0.45)
SCHEMBL12471491 0.65 CLK1 (0.40)

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
CN-113429399-A Pyrene derivative, light emitting device material and light emitting device 浙江华显光电科技有限公司 2021-09-24 CN disclosed
US-7566781-B2 Imidazopyridine compound BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-07-28 US disclosed
US-20070249659-A1 melanin concentrating hormone receptor antagonist; preventing or treating vascular system diseases, nervous system disorders, metabolic disorders, urogenital diseases, respiratory diseases disorders; N-(2-ethyl-3-methylimidazo[1,2-a]pyridin-6-yl)-3-fluoro-4-(pyridin-2-ylmethoxy)benzamide BANYU PHARMACEUTICAL., LTD. (JP) 2007-10-25 US disclosed
EP-1748048-A1 IMIDAZOPYRIDINE COMPOUND BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-01-31 EP disclosed