SCHEMBL2607953

SCHEMBL2607953

COCCOC(=O)NCCOCCOCCNC(=O)CCCN1C(=O)CC(C)C1=O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ HPGD P15428 2/20 0.51
▸ HTT P42858 1/20 0.51
▸ TP53 P04637 3/20 0.37
▸ DRD2 P14416 1/20 0.36
▸ TSHR P16473 2/20 0.35
▸ ALDH1A1 P00352 4/20 0.34
▸ OPRM1 P35372 1/20 0.34
▸ CYP2C19 P33261 3/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33

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
SCHEMBL14274958 0.93 HPGD (0.52) SMN1; SMN2HPGDHTTTP53DRD2
SCHEMBL14264553 0.93 SMN1; SMN2 (0.53) SMN1; SMN2HPGDHTTTP53DRD2
SCHEMBL24686923 0.91 SMN1; SMN2 (0.62) SMN1; SMN2HPGDHTTTP53DRD2
SCHEMBL23181275 0.89 SMN1; SMN2 (0.49) SMN1; SMN2HPGDHTTTP53DRD2
SCHEMBL13225533 0.88 SMN1; SMN2 (0.49) SMN1; SMN2HPGDHTTTP53DRD2
SCHEMBL2607942 0.87 SMN1; SMN2 (0.48) SMN1; SMN2HPGDHTTTP53DRD2
SCHEMBL24686260 0.87 SMN1; SMN2 (0.50) SMN1; SMN2HPGDHTTTSHRALDH1A1
SCHEMBL18470794 0.86 HPGD (0.47) SMN1; SMN2HPGDHTTTP53DRD2
SCHEMBL12918819 0.86 SMN1; SMN2 (0.56) SMN1; SMN2HPGDHTTDRD2TSHR
SCHEMBL14870351 0.85 HTT (0.46) SMN1; SMN2HPGDHTTTP53DRD2

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-9861705-B2 Conjugates of an IL-2 moiety and a polymer NEKTAR THERAPEUTICS (US) 2018-01-09 — — US disclosed
US-20170035898-A1 CONJUGATES OF AN IL-15 MOIETY AND A POLYMER NEKTAR THERAPEUTICS 2017-02-09 — — US disclosed
US-20140328791-A1 Conjugates of an IL-2 Moiety and a Polymer NEKTAR THERAPEUTICS 2014-11-06 — — US disclosed
US-20120100096-A1 CONJUGATES PF SMALL-INTERFERING NUCLEIC ACIDS NEKTAR THERAPEUTICS (US) 2012-04-26 — — US disclosed
US-20110269713-A1 BRYOSTATIN ANALOGUES AND METHODS OF MAKING AND USING THEREOF UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2011-11-03 — — US disclosed
US-20110171163-A1 POLYMER CONJUGATES OF ZICONOTIDE PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-14 — — US disclosed
US-20110171161-A1 POLYMER CONJUGATES OF PROTEGRIN PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-14 — — US disclosed
US-20110165113-A1 POLYMER CONJUGATES OF V681-LIKE PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-07 — — US 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 (7 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-20140328791-A1 Conjugates of an IL-2 Moiety and a Polymer IL2, IL2RA, ILF2 SMN1; SMN2 3123/4885HPGD 712/4885HTT 3288/4885
US-20110171163-A1 POLYMER CONJUGATES OF ZICONOTIDE PEPTIDES NGLY1, VIP, IAPP SMN1; SMN2 1670/4885HPGD 1423/4885HTT 1909/4885
US-20110171161-A1 POLYMER CONJUGATES OF PROTEGRIN PEPTIDES PSMG3, PSMB11, PSMC5 SMN1; SMN2 1077/4885HPGD 1965/4885HTT 124/4885
US-20110269713-A1 BRYOSTATIN ANALOGUES AND METHODS OF MAKING AND USING THEREOF PRKAR2B, PRKAR2A, PRKCH SMN1; SMN2 3279/4885HPGD 2235/4885HTT 2587/4885
US-20110165113-A1 POLYMER CONJUGATES OF V681-LIKE PEPTIDES NGLY1, VIP, DNPEP SMN1; SMN2 2851/4885HPGD 4475/4885HTT 1055/4885
US-20120100096-A1 CONJUGATES PF SMALL-INTERFERING NUCLEIC ACIDS SLC19A1, FOLR1, SLC46A1 SMN1; SMN2 164/4885HPGD 3787/4885HTT 909/4885
US-20170035898-A1 CONJUGATES OF AN IL-15 MOIETY AND A POLYMER IL15, IL15RA, IL2 SMN1; SMN2 4077/4885HPGD 154/4885HTT 1539/4885

“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.

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