SCHEMBL3917849

SCHEMBL3917849

O=C(O)N[C@H]1CN(c2cc(Cl)ncn2)C[C@@H]1N1CCCC1=O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 11/20 0.48
▸ DPP8 Q6V1X1 2/20 0.38
▸ MMP2 P08253 1/20 0.33
▸ ADAMTS5 Q9UNA0 1/20 0.33
▸ BTK Q06187 2/20 0.33
▸ VNN1 O95497 1/20 0.31
▸ PSEN1 P49768 1/20 0.31
▸ PSEN2 P49810 1/20 0.31
▸ APH1B Q8WW43 1/20 0.31
▸ NCSTN Q92542 1/20 0.31
▸ APH1A Q96BI3 1/20 0.31
▸ PSENEN Q9NZ42 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ JAK2 O60674 1/20 0.31
▸ JAK1 P23458 1/20 0.31
▸ JAK3 P52333 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
SCHEMBL3917855 1.00 DPP4 (0.48) DPP4DPP8MMP2ADAMTS5BTK
SCHEMBL8221580 0.86 DPP4 (0.43) DPP4DPP8BTKVNN1JAK3
SCHEMBL3920732 0.84 DPP4 (0.48) DPP4DPP8BTKSMN1; SMN2
SCHEMBL3920725 0.84 DPP4 (0.48) DPP4DPP8BTKSMN1; SMN2
SCHEMBL21434133 0.75 CHRM4 (0.39) BTK
SCHEMBL8217907 0.74 DPP4 (0.43) DPP4DPP8BTKVNN1JAK3
SCHEMBL23492799 0.71 PSEN1 (0.42) BTKPSEN1PSEN2APH1BNCSTN
SCHEMBL23492798 0.71 PSEN1 (0.42) BTKPSEN1PSEN2APH1BNCSTN
SCHEMBL23492797 0.71 PSEN1 (0.42) BTKPSEN1PSEN2APH1BNCSTN
SCHEMBL5924085 0.71 DPP4 (0.48) DPP4DPP8

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-7485641-B2 Substituted 3-amino-pyrrolidino-4-lactams PFIZER, INC. (US) 2009-02-03 — — US disclosed
US-20070299076-A1 Substituted 3-Amino-Pyrrolidino-4-Lactams PFIZER INC 2007-12-27 — — 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-20070299076-A1 Substituted 3-Amino-Pyrrolidino-4-Lactams PRMT1, PRMT7, PRMT3 DPP4 783/4885DPP8 1978/4885MMP2 2413/4885

“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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