SCHEMBL26148261

SCHEMBL26148261

CN(CCC#N)C1CCN(C(=O)CC(C)(C)C)CC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 10/20 0.40
CYP3A4 P08684 1/20 0.39
JAK2 O60674 3/20 0.34
FAAH O00519 1/20 0.34
JAK3 P52333 1/20 0.34
JAK1 P23458 2/20 0.33
RET P07949 1/20 0.32
AOC2 O75106 1/20 0.32
GPR119 Q8TDV5 1/20 0.32

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
SCHEMBL18909336 0.85 EPHX2 (0.39) JAK2JAK3JAK1
SCHEMBL22030495 0.80 NPC1 (0.41) DPP4CYP3A4FAAH
SCHEMBL26148281 0.79 DPP4 (0.41) DPP4CYP3A4JAK2FAAHJAK1
SCHEMBL22891660 0.78 DPP4 (0.38) DPP4CYP3A4JAK2FAAHJAK1
SCHEMBL22891648 0.76 CYP3A4 (0.40) DPP4CYP3A4FAAH
SCHEMBL22030873 0.76 CYP3A4 (0.41) DPP4CYP3A4FAAH
SCHEMBL22030876 0.76 CYP3A4 (0.41) DPP4CYP3A4FAAH
SCHEMBL17281953 0.75 JAK2 (0.39) JAK2JAK3
SCHEMBL26148275 0.75 MEN1 (0.43) JAK2JAK1
SCHEMBL26148274 0.74 DPP4 (0.41) DPP4FAAHJAK1

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-11795170-B2 Therapeutic compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2023-10-24 US disclosed
US-11649241-B2 Pyrazolochlorophenyl compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2023-05-16 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 (2 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-11795170-B2 Therapeutic compounds, compositions and methods of use thereof JAK2, JAK1, JAK3 DPP4 1158/4885CYP3A4 2930/4885JAK2 1/4885
US-11649241-B2 Pyrazolochlorophenyl compounds, compositions and methods of use thereof JAK1, JAK2, JAK3 DPP4 1302/4885CYP3A4 380/4885JAK2 2/4885

“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.