SCHEMBL19681237

SCHEMBL19681237

CNCCCOCCOCCOCCCNC(=O)C1CCCN1C(C)=O

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.55
POLB P06746 1/20 0.55
NPSR1 Q6W5P4 1/20 0.47
KMT2A Q03164 2/20 0.45
P2RX7 Q99572 1/20 0.42
TNKS O95271 2/20 0.42
FKBP1A P62942 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALOX15 P16050 1/20 0.40
F2 P00734 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL21351127 0.92 POLB (0.47) TSHRPOLBNPSR1KMT2AP2RX7
SCHEMBL21347506 0.91 POLB (0.47) TSHRPOLBNPSR1KMT2AP2RX7
SCHEMBL21351088 0.90 TSHR (0.58) TSHRPOLBNPSR1KMT2AP2RX7
SCHEMBL19681206 0.89 TSHR (0.54) TSHRPOLBNPSR1KMT2AP2RX7
SCHEMBL20370185 0.86 TSHR (0.52) TSHRPOLBNPSR1KMT2AP2RX7
SCHEMBL20370134 0.85 TNKS (0.50) TSHRPOLBNPSR1KMT2AP2RX7
SCHEMBL21339696 0.84 TSHR (0.50) TSHRPOLBNPSR1KMT2AP2RX7
SCHEMBL18410302 0.84 TSHR (0.54) TSHRPOLBNPSR1KMT2AP2RX7
SCHEMBL25851080 0.83 POLB (0.51) TSHRPOLBNPSR1KMT2AFKBP1A
SCHEMBL21339811 0.83 TSHR (0.48) TSHRPOLBNPSR1KMT2AP2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10548952-B2 Injectable solution at pH7 comprising at least one basal insulin the pI of which is from 5.8 to 8.5, a prandial insulin and/or a gastrointestinal hormone, and a co-polyamino acid bearing carboxylate charges and hydrophobic radicals ADOCIA (FR) 2020-02-04 US disclosed
US-20190275108-A1 COMPOSITIONS IN THE FORM OF AN INJECTABLE AQUEOUS SOLUTION COMPRISING AMYLIN, AN AMYLIN RECEPTOR AGONIST OR AN AMYLIN ANALOGUE AND A CO-POLYAMINO ACID ADOCIA (FR) 2019-09-12 US disclosed
US-20170348396-A1 Injectable solution at pH7 comprising at least one basal insulin the pI of which is from 5.8 to 8.5, a prandial insulin and/or a gastrointestinal hormone, and a co-polyamino acid bearing carboxylate charges and hydrophobic radicals ADOCIA (FR) 2017-12-07 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 (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-20190275108-A1 COMPOSITIONS IN THE FORM OF AN INJECTABLE AQUEOUS SOLUTION COMPRISING AMYLIN, AN AMYLIN RECEPTOR AGONIST OR AN AMYLIN ANALOGUE AND A CO-POLYAMINO ACID IAPP, GPR119, GLP1R TSHR 428/4885POLB 3577/4885NPSR1 147/4885
US-20170348396-A1 Injectable solution at pH7 comprising at least one basal insulin the pI of which is from 5.8 to 8.5, a prandial insulin and/or a gastrointestinal hormone, and a co-polyamino acid bearing carboxylate charges and hydrophobic radicals IAPP, F7, GIPR TSHR 239/4885POLB 2451/4885NPSR1 1316/4885
US-10548952-B2 Injectable solution at pH7 comprising at least one basal insulin the pI of which is from 5.8 to 8.5, a prandial insulin and/or a gastrointestinal hormone, and a co-polyamino acid bearing carboxylate charges and hydrophobic radicals IAPP, F7, GIPR TSHR 239/4885POLB 2451/4885NPSR1 1316/4885

“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.