SCHEMBL24040342

SCHEMBL24040342

NCCNC(=O)COCCOCCOCCOCCOCCOCCN

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
NCF1 P14598 1/20 0.33
TSHR P16473 2/20 0.33
RECQL P46063 1/20 0.33
CA12 O43570 4/20 0.32
CA1 P00915 4/20 0.32
CA4 P22748 4/20 0.32
CA9 Q16790 4/20 0.32
CA14 Q9ULX7 4/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP1A2 P05177 1/20 0.31
NFKB1 P19838 1/20 0.31

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
SCHEMBL24040332 0.92 MEN1 (0.41) CA2KMT2AMEN1NCF1TSHR
SCHEMBL20017289 0.88 MEN1 (0.41) CA2KMT2AMEN1NCF1TSHR
SCHEMBL12589997 0.87 TSHR (0.42) CA2KMT2AMEN1TSHRALDH1A1
SCHEMBL21172350 0.87 MEN1 (0.38) CA2KMT2AMEN1NCF1TSHR
SCHEMBL24838579 0.87 TSHR (0.39) KMT2AMEN1TSHRRECQLALDH1A1
SCHEMBL12730446 0.87 TSHR (0.42) CA2KMT2AMEN1TSHRALDH1A1
SCHEMBL15750359 0.87 HDAC3 (0.33) CA2KMT2AMEN1NCF1TSHR
SCHEMBL13018276 0.86 GLP1R (0.36) TSHRRECQLCYP2C19
SCHEMBL15765871 0.85 MEN1 (0.37) CA2KMT2AMEN1NCF1TSHR
SCHEMBL1257485 0.85 GLP1R (0.41) CA2KMT2AMEN1NCF1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11179467-B2 Exenatide modifier and use thereof BRIGHTGENE BIO-MEDICAL TECHNOLOGY CO., LTD. (CN) 2021-11-23 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 (1 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-11179467-B2 Exenatide modifier and use thereof GLP1R, GCGR, GIPR CA2 4646/4885KMT2A 3214/4885MEN1 1193/4885

“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.