SCHEMBL7702161

SCHEMBL7702161

O=c1[nH]c(NOCc2ccccc2)nc2nc[nH]c12

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
SCHEMBL8583453 0.81 GDA (0.57)
SCHEMBL18251 0.81 PNP (0.62)
SCHEMBL27775482 0.80 XDH (0.61)
SCHEMBL1394088 0.80 PNP (0.61)
SCHEMBL17554279 0.79 XDH (0.63)
SCHEMBL27496341 0.78 GDA (0.62)
SCHEMBL27503507 0.78 XDH (0.62)
Cyanide SCHEMBL2694132 0.78 PNP (0.58)
SCHEMBL5198603 0.77 GDA (0.61)
SCHEMBL1286951 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5525726-A Process for the preparation of an antiviral agent E. R. SQUIBB & SONS, INC. (US) 1996-06-11 US claimed
US-5516903-A Process for preparing [IR-(1α,2β-3α)]-2-amino-9-[2,3-bis(hydroxymethyl)cyclobutyl]-1,9-dihydro-6H-purin-6-one E. R. SQUIBB & SONS, INC. (US) 1996-05-14 US claimed
CN-117924514-B Probe system for detecting cholesterol and application thereof 重庆医科大学 2025-04-04 CN disclosed
CN-117924514-A Probe system for detecting cholesterol and application thereof 重庆医科大学 2024-04-26 CN disclosed
US-6353122-B1 IN CYCLOHEXANONE WITH POTASSIUM PEROXYMONOSULFATE AND SUBSEQUENT REARRANGEMENT TO PROVIDE THE CORRESPONDING CYCLOBUTANONE BRISTOL-MYERS SQUIBB COMPANY 2002-03-05 US disclosed
CN-1040426-C Process for preparing diprotected 2,3-hydroxymethyl cyclobutanol SQUIBB & SONS INC (US) 1998-10-28 CN disclosed
WO-1998038184-A1 A METHOD FOR EPOXIDATION OF 3-METHYLENECYCLOPROPANES BRISTOL-MYERS SQUIBB COMPANY (US) 1998-09-03 WO disclosed
EP-0535448-B1 Process and intermediates for the preparation of an antiviral agent containing a cyclobutyl group SQUIBB & SONS INC (US) 1996-06-26 EP disclosed
US-5525726-A Process for the preparation of an antiviral agent E. R. SQUIBB & SONS, INC. (US) 1996-06-11 US disclosed
US-5516903-A Process for preparing [IR-(1α,2β-3α)]-2-amino-9-[2,3-bis(hydroxymethyl)cyclobutyl]-1,9-dihydro-6H-purin-6-one E. R. SQUIBB & SONS, INC. (US) 1996-05-14 US disclosed
US-5412134-A Process for preparing diprotected 2,3-hydroxymethyl cyclobutanol E. R. SQUIBB & SONS, INC. (US) 1995-05-02 US disclosed
CN-1082025-A 2 of two protections, the preparation method of 3-methylol cyclobutanol SQUIBB & SONS INC (US) 1994-02-16 CN disclosed
EP-0572209-A2 Process for preparing diprotected 2,3-hydroxymethyl cyclobutanol E.R. SQUIBB & SONS, INC. (US) 1993-12-01 EP disclosed
US-5237095-A Process for the preparation of an antiviral agent E. R. SQUIBB & SONS, INC. (US) 1993-08-17 US disclosed
US-5237096-A Process for the preparation of an antiviral agent E. R. SQUIBB & SONS, INC. (US) 1993-08-17 US disclosed
US-5233086-A Intermediates for the preparation of an antiviral agent E. R. SQUIBB & SONS, INC. (US) 1993-08-03 US disclosed
US-5218142-A Process for the preparation of an antiviral agent E. R. SQUIBB & SONS, INC. (US) 1993-06-08 US disclosed
EP-0535448-A2 Process and intermediates for the preparation of an antiviral agent containing a cyclobutyl group E.R. SQUIBB &amp; SONS, INC. (US) 1993-04-07 EP disclosed
US-5185463-A PROCESS FOR THE PREPARATION OF AN ANTIVIRAL AGENT E. R. SQUIBB & SONS, INC. (US) 1993-02-09 US disclosed