SCHEMBL280281

SCHEMBL280281

CCCCC(=O)NCCOCCCOC

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.61
CNR1 P21554 1/20 0.55
ENPP2 Q13822 1/20 0.46
LPAR1 Q92633 1/20 0.46
LPAR2 Q9HBW0 1/20 0.46
HPGD P15428 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
FAAH O00519 3/20 0.45
CASP2 P42575 1/20 0.44
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
DNM1 Q05193 1/20 0.42
NAAA Q02083 1/20 0.42

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
SCHEMBL19751773 0.92 TSHR (0.58) TSHRCNR1ENPP2LPAR1LPAR2
SCHEMBL19871336 0.92 TSHR (0.58) TSHRCNR1ENPP2LPAR1LPAR2
SCHEMBL16203711 0.92 TSHR (0.58) TSHRCNR1ENPP2LPAR1LPAR2
SCHEMBL279863 0.90 FAAH (0.50) TSHRCNR1ENPP2LPAR1LPAR2
SCHEMBL25110141 0.89 TSHR (0.56) TSHRCNR1ENPP2LPAR1LPAR2
SCHEMBL17635394 0.89 TSHR (0.74) TSHRCNR1HPGDMEN1KMT2A
SCHEMBL26208462 0.88 CASP2 (0.53) TSHRCNR1ENPP2LPAR1LPAR2
SCHEMBL20470066 0.88 FAAH (0.49) TSHRCNR1ENPP2LPAR1LPAR2
SCHEMBL13501556 0.88 CNR1 (0.67) TSHRCNR1ENPP2LPAR1LPAR2
SCHEMBL26700382 0.87 CNR1 (0.58) TSHRCNR1ENPP2LPAR1LPAR2

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-9421275-B2 Oligomer-calcimimetic conjugates and related compunds NEKTAR THERAPEUTICS (US) 2016-08-23 US disclosed
US-20140328791-A1 Conjugates of an IL-2 Moiety and a Polymer NEKTAR THERAPEUTICS 2014-11-06 US disclosed
US-20140323565-A1 Oligomer-Calcimimetic Conjugates and Related Compunds NEKTAR THERAPEUTICS (US) 2014-10-30 US disclosed
US-8435505-B2 Pharmaceutical compositions and methods for delivering such compositions NEKTAR THERAPEUTICS (US) 2013-05-07 US disclosed
US-20120258912-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR DELIVERING SUCH COMPOSITIONS NEKTAR THERAPEUTICS (US) 2012-10-11 US disclosed
US-8133865-B2 Two polymer chains (especially polyethylene oxide) connected to each other through a fluorenedicarbamoylmethyl group, which in turn is connected to an amine active agent by a releasable carbamate linkage; increased in vivo half-life NEKTAR THERAPEUTICS (US) 2012-03-13 US disclosed
US-20080234193-A1 Von Willebrand factor-and factor VIII-polymer conjugates having a releasable linkage NEKTAR THERAPEUTICS AL, CORPORATION (US) 2008-09-25 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 (4 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 TSHR 2859/4885CNR1 4173/4885ENPP2 544/4885
US-20120258912-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR DELIVERING SUCH COMPOSITIONS ABCG2, SI, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 TSHR 3934/4885CNR1 1450/4885ENPP2 2258/4885
US-20080234193-A1 Von Willebrand factor-and factor VIII-polymer conjugates having a releasable linkage F8, F13A1, F13B TSHR 4142/4885CNR1 4798/4885ENPP2 228/4885
US-20140323565-A1 Oligomer-Calcimimetic Conjugates and Related Compunds CALCR, CALCB, CALCA TSHR 1757/4885CNR1 1084/4885ENPP2 42/4885

“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.