SCHEMBL16622177

SCHEMBL16622177

CCC(=O)NCCC[C@H](NC)C(C)=O

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ RECQL P46063 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ CASP2 P42575 1/20 0.35
▸ KISS1R Q969F8 1/20 0.35
▸ TSHR P16473 1/20 0.34
▸ FAAH O00519 1/20 0.34
▸ SIRT6 Q8N6T7 1/20 0.34
▸ SIRT1 Q96EB6 1/20 0.34
▸ PSEN1 P49768 1/20 0.33
▸ PSEN2 P49810 1/20 0.33
▸ APH1B Q8WW43 1/20 0.33
▸ NCSTN Q92542 1/20 0.33
▸ APH1A Q96BI3 1/20 0.33
▸ PSENEN Q9NZ42 1/20 0.33

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
SCHEMBL13124556 0.95 MEN1 (0.59) MEN1KMT2ARECQLALDH1A1SMN1; SMN2
SCHEMBL25968884 0.95 MEN1 (0.59) MEN1KMT2ARECQLALDH1A1SMN1; SMN2
SCHEMBL25968834 0.89 MEN1 (0.48) MEN1KMT2ARECQLALDH1A1
SCHEMBL24641589 0.86 SMN1; SMN2 (0.37) MEN1KMT2AALDH1A1SMN1; SMN2KISS1R
SCHEMBL21964562 0.86 ALDH1A1 (0.44) MEN1KMT2AALDH1A1SMN1; SMN2CASP2
SCHEMBL17128632 0.84 KISS1R (0.38) MEN1KMT2AALDH1A1SMN1; SMN2CASP2
SCHEMBL24372267 0.83 MEN1 (0.57) MEN1KMT2ARECQLCASP2SIRT6
SCHEMBL23772060 0.83 MEN1 (0.57) MEN1KMT2ARECQLCASP2SIRT6
SCHEMBL18412629 0.82 ALDH1A1 (0.55) MEN1KMT2AALDH1A1SMN1; SMN2CASP2
SCHEMBL16174166 0.81 CASP2 (0.56) MEN1KMT2ACASP2TSHRFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150175665-A1 ANALOGUES OF GLUCOSE-DEPENDENT INSULINOTROPIC POLYPEPTIDE (GIP) MODIFIED AT N-TERMINAL IPSEN PHARMA S.A.S. (FR) 2015-06-25 — — US disclosed
US-8999940-B2 Analogues of glucose-dependent insulinotropic polypeptide (GIP) modified at N-terminal IPSEN PHARMA S.A.S. (FR) 2015-04-07 — — 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 (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-20150175665-A1 ANALOGUES OF GLUCOSE-DEPENDENT INSULINOTROPIC POLYPEPTIDE (GIP) MODIFIED AT N-TERMINAL GIPR, GPR119, GLP1R MEN1 1086/4885KMT2A 3970/4885RECQL 4831/4885

“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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