SCHEMBL7948694

SCHEMBL7948694

CC(C)N(C(C)C)N(Cl)P(O)OOCCC#N

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
SCHEMBL1856537 0.84
SCHEMBL313598 0.80 TSHR (0.31)
SCHEMBL11904391 0.73
SCHEMBL8817758 0.73
SCHEMBL7153188 0.70
SCHEMBL2407459 0.70
SCHEMBL7081474 0.69 TSHR (0.30)
SCHEMBL2522703 0.69 TSHR (0.30)
SCHEMBL1069685 0.69 NLRP3 (0.31)
SCHEMBL8143353 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6262036-B1 CHIMERIC OLIGONUCLEOSIDE COMPOUNDS USEFUL IN ACTIVATING RNASEH-MEDIATED CLEAVAGE OF TARGET RIBONUCLEIC ACID SEQUENCES, AND IN TREATING DISEASE CONDITIONS RELATING TO SUCH SEQUENCES. GENTA INCORPORATED 2001-07-17 US disclosed
US-6060456-A RNASE ACTIVATING REGION; GENETIC ENGINEERING; MOLECULAR HYBRIDIZATION GENTA INCORPORATED (US) 2000-05-09 US disclosed
US-6028188-A Synthetic oligomers having chirally pure phosphonate internucleosidyl linkages mixed with non-phosphonate internucleosidyl linkages GENTA INCORPORATED (US) 2000-02-22 US disclosed
US-5986083-A IDENTIFYING SINGLE STRANDED RNA TARGET SEQUENCE AND SYNTHESIZING COMPLEMENTARY OLIGOMER OF MIXED NUCLEOSIDES WITH ALTERNATING RACEMIC ARYL- OR LOWER ALKYL-PHOSPHONATE LINKAGES; HAS NUCLEASE STABILITY AND ENHANCED HYBRIDIZATION BINDING GENTA, INC. (US) 1999-11-16 US disclosed
US-5811538-A NORMAL PHASE COLUMN CHROMATOGRAPHY ON SUPPORT COMPRISING POLYHYDROXYETHYL ASPARTAMIDE, SILICA, HYDROPHILIC SILICA GENTA, INCORPORATED (US) 1998-09-22 US disclosed
US-5792615-A ANTISENSE NUCLEOTIDES PREVENTING OR INTERFERING THE GENE EXPRESSION OR TRANSLATION OF SINGLE-STRANDED RNA GENTA, INCORPORATED (US) 1998-08-11 US disclosed
EP-0743859-A1 CHIMERIC OLIGONUCLEOSIDE COMPOUNDS GENTA INCORPORATED (US) 1996-11-27 EP disclosed