SCHEMBL12417191

SCHEMBL12417191

CNC(=O)CCC(=O)NCCCOC

nearest known ligand 0.75

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.75
▸ KDM4E B2RXH2 2/20 0.55
▸ LMNA P02545 1/20 0.55
▸ HPGD P15428 3/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ ALDH1A1 P00352 3/20 0.50
▸ MAPT P10636 1/20 0.48
▸ RECQL P46063 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ GAA P10253 1/20 0.46
▸ HTT P42858 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ EPHX2 P34913 1/20 0.42
▸ CNR1 P21554 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL10044368 0.94 TSHR (0.85) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL21821634 0.86 TSHR (0.84) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL12421753 0.85 TSHR (0.75) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL19370866 0.85 TSHR (0.75) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL27368810 0.85 TSHR (0.75) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL12013650 0.84 TSHR (0.88) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL4270085 0.84 TSHR (0.88) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL8574782 0.84 TSHR (0.88) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL12013653 0.84 TSHR (0.88) TSHRKDM4ELMNAHPGDMEN1
SCHEMBL23735522 0.83 CASP2 (0.56) TSHRKDM4ELMNAHPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170035896-A1 POLYMER FACTOR IX MOIETY CONJUGATES NEKTAR THERAPEUTICS 2017-02-09 — — US disclosed
US-9446139-B2 Polymer-based compositions and conjugates of HIV entry inhibitors NEKTAR THERAPEUTICS (US) 2016-09-20 — — US disclosed
US-8586711-B2 Polymer-factor IX moiety conjugates NEKTAR THERAPEUTICS (US) 2013-11-19 — — US disclosed
US-8273339-B2 Polymer-based compositions and conjugates of antimicrobial agents NEKTAR THERAPEUTICS (US) 2012-09-25 — — US disclosed
US-20110171162-A1 POLYMER CONJUGATES OF THYMOSIN ALPHA 1 PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-14 — — 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 (5 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-20170035896-A1 POLYMER FACTOR IX MOIETY CONJUGATES F9, F13A1, F8 TSHR 2747/4885KDM4E 3324/4885LMNA 860/4885
US-20100120982-A1 POLYMER-FACTOR IX MOIETY CONJUGATES F9, F13A1, F13B TSHR 2396/4885KDM4E 3327/4885LMNA 1157/4885
US-20070092482-A1 Conjugates of a G-CSF moiety and a polymer CSF3R, GMFG, CSF1R TSHR 2742/4885KDM4E 4396/4885LMNA 3667/4885
US-20110171162-A1 POLYMER CONJUGATES OF THYMOSIN ALPHA 1 PEPTIDES TMSB4X, TMSB10, TAP1 TSHR 2408/4885KDM4E 4839/4885LMNA 4062/4885
US-20100160610-A1 Conjugates of an EPO Moiety and a Polymer EPOR, EPRS1, NPPA TSHR 1684/4885KDM4E 4201/4885LMNA 3400/4885

“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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