SCHEMBL21366084

SCHEMBL21366084

CNC(=O)c1nnc(C(C)(C)C)o1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.38
DPP8 Q6V1X1 3/20 0.38
DPP7 Q9UHL4 2/20 0.38
BTK Q06187 4/20 0.35
RAF1 P04049 1/20 0.33
ELANE P08246 8/20 0.32
CTSL P07711 1/20 0.30
CTSB P07858 1/20 0.30
CTSS P25774 1/20 0.30
CTSK P43235 1/20 0.30
CYP3A4 P08684 1/20 0.30

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
SCHEMBL17664593 0.83 DPP4 (0.40) DPP4DPP8DPP7BTKRAF1
SCHEMBL17664601 0.80 BTK (0.40) DPP4DPP8DPP7BTKELANE
SCHEMBL17645774 0.78 DPP4 (0.39) DPP4DPP8DPP7RAF1ELANE
SCHEMBL12734314 0.78 DPP4 (0.37) DPP4DPP8DPP7BTKRAF1
SCHEMBL8840142 0.78 PTPN1 (0.39) DPP4DPP8DPP7BTKRAF1
SCHEMBL17660274 0.76 RAB9A (0.40) DPP4DPP8DPP7BTKELANE
SCHEMBL17664602 0.76 DPP4 (0.36) DPP4DPP8DPP7BTKELANE
SCHEMBL29069466 0.76 PTPN1 (0.38) DPP4DPP8DPP7BTKRAF1
SCHEMBL2678471 0.76 DPP4 (0.36) DPP4DPP8DPP7BTKRAF1
SCHEMBL18407356 0.75 LMNA (0.46) RAF1

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-20190307731-A1 ARYL HYDROCARBON RECEPTOR MODULATOR ARIAGEN, INC. (US) 2019-10-10 US disclosed
US-20190284149-A1 ARYL HYDROCARBON RECEPTOR MODULATOR ARIAGEN, INC. (US) 2019-09-19 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-20190307731-A1 ARYL HYDROCARBON RECEPTOR MODULATOR AHR, ARNT, NR1H4 DPP4 4815/4885DPP8 4687/4885DPP7 4645/4885
US-20190284149-A1 ARYL HYDROCARBON RECEPTOR MODULATOR AHR, ARNT, NR1H4 DPP4 4695/4885DPP8 4496/4885DPP7 4477/4885

“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.