SCHEMBL4662836

SCHEMBL4662836

[CH2]CCCC(S)CCCC

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.36
MMP13 P45452 1/20 0.35
ALDH1A1 P00352 3/20 0.32
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 3/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP3A4 P08684 1/20 0.31
FDPS P14324 1/20 0.31
LMNA P02545 1/20 0.30
CA2 P00918 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL6257486 0.90 LMNA (0.39) DNM1TSHRFDPSLMNA
SCHEMBL9419491 0.90
SCHEMBL384819 0.86 DNM1 (0.45) DNM1MMP13ALDH1A1TDP1TSHR
SCHEMBL6255309 0.85 LMNA (0.39) DNM1TSHRFDPSLMNA
SCHEMBL10947406 0.83 DNM1 (0.43) DNM1MMP13ALDH1A1TDP1TSHR
Hydrochloric Acid SCHEMBL965472 0.83 DNM1 (0.43) DNM1MMP13ALDH1A1TDP1TSHR
SCHEMBL10941450 0.83 DNM1 (0.43) DNM1MMP13ALDH1A1TDP1TSHR
Bromide SCHEMBL3385366 0.83 DNM1 (0.43) DNM1MMP13ALDH1A1TDP1TSHR
Iodide SCHEMBL6383667 0.83 DNM1 (0.43) DNM1MMP13ALDH1A1TDP1TSHR
Water SCHEMBL7551987 0.83 DNM1 (0.43) DNM1MMP13ALDH1A1TDP1TSHR

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 92 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1212339-B1 2'-O-ACETAMIDO MODIFIED MONOMERS AND OLIGOMERS ISIS PHARMACEUTICALS INC (US) 2008-12-31 EP disclosed
EP-1496943-A4 OLIGOMERIC COMPOUNDS HAVING MODIFIED PHOSPHATE GROUPS ISIS PHARMACEUTICALS INC (US) 2007-05-23 EP disclosed
US-6991902-B2 Nucleobase heterocyclic combinatorialization ISIS PHARMACEUTICALS, INC. (US) 2006-01-31 US disclosed
US-20060003952-A1 Oligomeric compounds having modified phosphate groups ISIS PHARMACEUTICALS, INC. (US) 2006-01-05 US disclosed
US-6942966-B1 libraries formed by permutations; combinatorial chemistry; drug screening ISIS PHARMACEUTICALS, INC. (US) 2005-09-13 US disclosed
US-6933288-B2 Pyranosyl cytosines: pharmaceutical formulations and methods ISIS PHARMACEUTICALS, INC. 2005-08-23 US disclosed
EP-1223173-B1 Novel 2'-O-alkyl nucleosides and phosphoramidites processes for the preparation and uses thereof ISIS PHARMACEUTICALS INC (US) 2005-07-13 EP disclosed
US-20050106598-A1 Novel peptide-conjugated oligomeric compounds ISIS PHARMACEUTICALS, INC. 2005-05-19 US disclosed
US-6893815-B1 Nucleobase heterocyclic combinatorialization ISIS PHARMACEUTICALS, INC. (US) 2005-05-17 US disclosed
US-6878805-B2 Peptide-conjugated oligomeric compounds ISIS PHARMACEUTICALS, INC. (US) 2005-04-12 US disclosed
US-5506351-A Process for the preparation of 2'-O-alkyl guanosine and related compounds ISIS PHARMACEUTICALS (US) 1996-04-09 US disclosed
EP-0635023-A4 COVALENTLY CROSS-LINKED OLIGONUCLEOTIDES. ISIS PHARMACEUTICALS INC (US) 1996-03-20 EP disclosed
EP-0651759-A4 NOVEL 2'-O-ALKYL NUCLEOSIDES AND PHOSPHORAMIDITES PROCESSES FOR THE PREPARATION AND USES THEREOF. ISIS PHARMACEUTICALS INC (US) 1995-10-25 EP disclosed
WO-1995023160-A1 NOVEL PHOSPHORAMIDATE AND PHOPHOROTHIOAMIDATE OLIGOMERIC COMPOUNDS ISIS PHARMACEUTICALS, INC. (US) 1995-08-31 WO disclosed
WO-1995021184-A1 SUBSTITUTED PURINES AND OLIGONUCLEOTIDE CROSS-LINKING ISIS PHARMACEUTICALS, INC. (US) 1995-08-10 WO disclosed
WO-1995018623-A1 OLIGOMERIC COMPOUNDS HAVING NITROGEN-CONTAINING LINKAGES ISIS PHARMACEUTICALS, INC. (US) 1995-07-13 WO disclosed
EP-0651759-A1 NOVEL 2'-O-ALKYL NUCLEOSIDES AND PHOSPHORAMIDITES PROCESSES FOR THE PREPARATION AND USES THEREOF ISIS PHARMACEUTICALS, INC. (US) 1995-05-10 EP disclosed
EP-0635023-A1 COVALENTLY CROSS-LINKED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 1995-01-25 EP disclosed
WO-1994002501-A1 NOVEL 2'-O-ALKYL NUCLEOSIDES AND PHOSPHORAMIDITES PROCESSES FOR THE PREPARATION AND USES THEREOF ISIS PHARMACEUTICALS, INC. (US) 1994-02-03 WO disclosed
WO-1993018052-A1 COVALENTLY CROSS-LINKED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 1993-09-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050106598-A1 Novel peptide-conjugated oligomeric compounds IAPP, NGLY1, TAP1 DNM1 194/4885MMP13 3633/4885ALDH1A1 4829/4885
US-20060003952-A1 Oligomeric compounds having modified phosphate groups POLRMT, SNRPE, POLM DNM1 1500/4885MMP13 4428/4885ALDH1A1 4777/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.