SCHEMBL20100742

SCHEMBL20100742

CCCOCC(=O)NCCC(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.43
HTT P42858 2/20 0.43
HPGD P15428 3/20 0.43
CNR1 P21554 1/20 0.43
KMT2A Q03164 3/20 0.43
MAPT P10636 3/20 0.42
MEN1 O00255 2/20 0.42
LMNA P02545 2/20 0.39
PKM P14618 1/20 0.39
ANPEP P15144 3/20 0.38
RNPEP Q9H4A4 2/20 0.38
DNPEP Q9ULA0 2/20 0.38
GAA P10253 1/20 0.38
FAAH O00519 1/20 0.38
KDM4E B2RXH2 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL23589874 0.90 FAAH (0.42) SMN1; SMN2HTTHPGDCNR1KMT2A
SCHEMBL13328238 0.89 SMN1; SMN2 (0.46) SMN1; SMN2HTTHPGDCNR1KMT2A
SCHEMBL23589696 0.87 FAAH (0.47) KMT2AMEN1FAAHTSHRRECQL
SCHEMBL23589952 0.87 KMT2A (0.45) SMN1; SMN2HTTHPGDCNR1KMT2A
SCHEMBL23589903 0.87 FAAH (0.47) KMT2AMEN1FAAHTSHRRECQL
SCHEMBL23589698 0.87 FAAH (0.47) KMT2AMEN1FAAHTSHRRECQL
SCHEMBL18319068 0.86 SMN1; SMN2 (0.42) SMN1; SMN2HTTHPGDCNR1KMT2A
SCHEMBL23471188 0.85 SMN1; SMN2 (0.46) SMN1; SMN2HTTHPGDCNR1KMT2A
SCHEMBL26156218 0.84 HPGD (0.49) SMN1; SMN2HTTHPGDCNR1KMT2A
SCHEMBL24530494 0.83 HPGD (0.48) SMN1; SMN2HTTHPGDCNR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200268898-A1 GLP-1 RECEPTOR LIGAND MOIETY CONJUGATED OLIGONUCLEOTIDES AND USES THEREOF IONIS PHARMACEUTICALS, INC. 2020-08-27 US disclosed
WO-2019092618-A9 GLP-1 RECEPTOR LIGAND MOIETY CONJUGATED OLIGONUCLEOTIDES AND USES THEREOF IONIS PHARMACEUTICALS, INC (US) 2020-06-18 WO disclosed
US-20180118676-A1 NITRIC OXIDE DONATING DERIVATIVES OF LATANOPROST FREE ACID NICOX S.A. (FR) 2018-05-03 US disclosed
US-20180118677-A1 NITRIC OXIDE DONATING DERIVATIVES OF FLUPROSTENOL NICOX S.A. (FR) 2018-05-03 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 (3 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-20180118677-A1 NITRIC OXIDE DONATING DERIVATIVES OF FLUPROSTENOL PTGIS, NOS2, PTGIR SMN1; SMN2 4789/4885HTT 3882/4885HPGD 7/4885
US-20200268898-A1 GLP-1 RECEPTOR LIGAND MOIETY CONJUGATED OLIGONUCLEOTIDES AND USES THEREOF GLP1R, GIPR, GRPR SMN1; SMN2 3594/4885HTT 1631/4885HPGD 4678/4885
US-20180118676-A1 NITRIC OXIDE DONATING DERIVATIVES OF LATANOPROST FREE ACID PTGIS, NOS2, NOS1 SMN1; SMN2 4557/4885HTT 3043/4885HPGD 10/4885

“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.