SCHEMBL12417550

SCHEMBL12417550

CSSCCNC(=O)CCCC(=O)NCCSSC

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
FAAH O00519 4/20 0.40
CASP2 P42575 1/20 0.39
ALDH1A1 P00352 2/20 0.39
LPAR1 Q92633 1/20 0.39
DNM1 Q05193 2/20 0.38
MAPT P10636 1/20 0.38
NAAA Q02083 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
RECQL P46063 1/20 0.36
LMNA P02545 1/20 0.35
CNR1 P21554 1/20 0.35

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
SCHEMBL12422648 0.94 ALDH1A1 (0.48) TSHRFAAHCASP2ALDH1A1LPAR1
SCHEMBL13339624 0.91 TSHR (0.41) TSHRFAAHCASP2ALDH1A1LPAR1
SCHEMBL10025175 0.86 CASP2 (0.52) FAAHCASP2ALDH1A1LPAR1NAAA
SCHEMBL12417380 0.86 LPAR1 (0.40) FAAHALDH1A1LPAR1MAPTMEN1
SCHEMBL16015493 0.86 SLC6A5 (0.50) FAAHALDH1A1LPAR1DNM1MEN1
SCHEMBL18082922 0.85 TSHR (0.37) TSHRFAAHCASP2ALDH1A1LPAR1
SCHEMBL2607952 0.84 TSHR (0.36) TSHRFAAHALDH1A1LPAR1MEN1
SCHEMBL13225553 0.83 ALDH1A1 (0.58) TSHRFAAHCASP2ALDH1A1LPAR1
SCHEMBL20224856 0.81 MEN1 (0.54) TSHRALDH1A1MEN1KMT2ARECQL
SCHEMBL17936383 0.79 CASP2 (0.53) FAAHCASP2ALDH1A1LPAR1DNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9682153-B2 Polymer conjugates of therapeutic peptides NEKTAR THERAPEUTICS (US) 2017-06-20 US disclosed
US-9446139-B2 Polymer-based compositions and conjugates of HIV entry inhibitors NEKTAR THERAPEUTICS (US) 2016-09-20 US disclosed
US-9347054-B2 Polymer factor IX moiety conjugates NEKTAR THERAPEUTICS (US) 2016-05-24 US disclosed
US-20160022828-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS 2016-01-28 US disclosed
US-20140141483-A1 POLYMER FACTOR IX MOIETY CONJUGATES NEKTAR THERAPEUTICS (US) 2014-05-22 US disclosed
US-8586711-B2 Polymer-factor IX moiety conjugates NEKTAR THERAPEUTICS (US) 2013-11-19 US disclosed
US-8580919-B2 Polymer conjugates of GLP-1 NEKTAR THERAPEUTICS (US) 2013-11-12 US disclosed
US-8420068-B2 Polymer-based compositions and conjugates of antimicrobial agents NEKTAR THERAPEUTICS (US) 2013-04-16 US disclosed
US-8273339-B2 Polymer-based compositions and conjugates of antimicrobial agents NEKTAR THERAPEUTICS (US) 2012-09-25 US disclosed
US-20110171160-A1 POLYMER CONJUGATES OF KISS1 PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-14 US disclosed
US-20110171312-A1 MODIFIED THERAPEUTIC PEPTIDES, METHODS OF THEIR PREPARATION AND USE NEKTAR THERAPEUTICS (US) 2011-07-14 US disclosed
US-20110135623-A1 Conjugates of a Cholinesterase Moiety and a Polymer NEKTAR THERAPEUTICS (US) 2011-06-09 US disclosed
US-20100160610-A1 Conjugates of an EPO Moiety and a Polymer NEKTAR THERAPEUTICS (US) 2010-06-24 US disclosed
US-20100120982-A1 POLYMER-FACTOR IX MOIETY CONJUGATES NEKTAR THERAPEUTICS (US) 2010-05-13 US disclosed
US-7714114-B2 Conjugates of an EPO moiety and a polymer NEKTAR THERAPEUTICS (US) 2010-05-11 US disclosed
US-20090280550-A1 Polymer-Factor IX Moiety Conjugates NEKTAR THERAPEUTICS AL, CORPORATION (US) 2009-11-12 US disclosed
US-7579444-B2 Polymer-factor IX moiety conjugates NEKTAR THERAPEUTICS AL, CORPORATION (US) 2009-08-25 US disclosed
US-20070092482-A1 Conjugates of a G-CSF moiety and a polymer NEKTAR THERAPEUTICS 2007-04-26 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-20110171160-A1 POLYMER CONJUGATES OF KISS1 PEPTIDES KISS1R, PROKR1, NGLY1 TSHR 3332/4885FAAH 3646/4885CASP2 4680/4885
US-20110135623-A1 Conjugates of a Cholinesterase Moiety and a Polymer BCHE, ACHE, DNPEP TSHR 2764/4885FAAH 513/4885CASP2 3897/4885
US-20100120982-A1 POLYMER-FACTOR IX MOIETY CONJUGATES F9, F13A1, F13B TSHR 2396/4885FAAH 3471/4885CASP2 4219/4885
US-20160022828-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP TSHR 2749/4885FAAH 4134/4885CASP2 4103/4885
US-20070092482-A1 Conjugates of a G-CSF moiety and a polymer CSF3R, GMFG, CSF1R TSHR 2742/4885FAAH 3126/4885CASP2 4292/4885
US-20110171312-A1 MODIFIED THERAPEUTIC PEPTIDES, METHODS OF THEIR PREPARATION AND USE DNPEP, VIP, PTMS TSHR 1715/4885FAAH 4253/4885CASP2 2978/4885
US-20100160610-A1 Conjugates of an EPO Moiety and a Polymer EPOR, EPRS1, NPPA TSHR 1684/4885FAAH 3510/4885CASP2 4617/4885

“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.