SCHEMBL20857568

SCHEMBL20857568

CC(C)NCC(=O)N1CCC(C(=O)C(C)C)CC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 2/20 0.46
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ PTPN1 P18031 1/20 0.38
▸ TSHR P16473 1/20 0.37
▸ TLR9 Q9NR96 1/20 0.37
▸ TLR8 Q9NR97 1/20 0.37
▸ TLR7 Q9NYK1 1/20 0.37
▸ GAA P10253 1/20 0.36
▸ EPHX2 P34913 2/20 0.36
▸ HSD17B10 Q99714 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ MAPK1 P28482 1/20 0.35

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
SCHEMBL23553767 0.83 KMT2A (0.60) DPP4MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL20468901 0.81 DPP4 (0.43) DPP4MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL23553271 0.80 HSD17B10 (0.45) DPP4MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL23553276 0.80 DPP4 (0.48) DPP4MEN1KMT2AALDH1A1NPC1
SCHEMBL23185467 0.80 EPHX2 (0.46) ALDH1A1NPC1GAAEPHX2MAPT
SCHEMBL30920935 0.79 DPP4 (0.47) DPP4MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL2645027 0.79 DPP4 (0.47) DPP4MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL16643863 0.78 PTPN1 (0.54) MEN1KMT2ASMN1; SMN2ALDH1A1NPC1
SCHEMBL20381554 0.77 CYP2D6 (0.50) DPP4MEN1KMT2AALDH1A1NPC1
SCHEMBL145918 0.77 DPP4 (0.46) DPP4MEN1KMT2ASMN1; SMN2ALDH1A1

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-10246410-B2 Hydrazinyl and aminooxy compounds and their methods of use Life Technologies Corporation (US) 2019-04-02 — — 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-10246410-B2 Hydrazinyl and aminooxy compounds and their methods of use PHYKPL, AASDHPPT, CA14 DPP4 127/4885MEN1 4112/4885KMT2A 2304/4885

“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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