SCHEMBL3932202

SCHEMBL3932202

N[C@@H]1CN(Cc2ccccc2)C[C@@H]1N1CC(F)(F)CCC1=O

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 7/20 0.47
▸ S1PR1 P21453 1/20 0.38
▸ S1PR5 Q9H228 1/20 0.38
▸ TACR1 P25103 4/20 0.38
▸ GAA P10253 1/20 0.37
▸ FUCA1 P04066 2/20 0.36
▸ CHRM2 P08172 2/20 0.35
▸ CHRM3 P20309 2/20 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
SCHEMBL3932194 1.00 DPP4 (0.47) DPP4S1PR1S1PR5TACR1GAA
SCHEMBL1721376 0.81 S1PR1 (0.37) S1PR1S1PR5FUCA1CHRM2CHRM3
SCHEMBL3926744 0.81 S1PR1 (0.37) S1PR1S1PR5FUCA1CHRM2CHRM3
SCHEMBL3926747 0.81 S1PR1 (0.37) S1PR1S1PR5FUCA1CHRM2CHRM3
SCHEMBL150105 0.79 L3MBTL1 (0.47) DPP4S1PR1S1PR5TACR1FUCA1
SCHEMBL3919422 0.78 DRD2 (0.37) —
SCHEMBL148558 0.75 KMT2A (0.42) —
SCHEMBL148557 0.75 KMT2A (0.42) —
SCHEMBL31599630 0.71 L3MBTL1 (0.51) TACR1GAA
SCHEMBL19327458 0.70 FUCA1 (0.60) DPP4S1PR1S1PR5FUCA1

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-7485641-B2 Substituted 3-amino-pyrrolidino-4-lactams PFIZER, INC. (US) 2009-02-03 — — US disclosed
WO-2007148185-A2 SUBSTITUTED 3 -AMINO- PYRROLIDINO-4 -LACTAMS AS DPP INHIBITORS PFIZER PRODUCTS INC. (US) 2007-12-27 — — WO 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 783/4885S1PR1 2333/4885S1PR5 2464/4885

“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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