SCHEMBL25815899

SCHEMBL25815899

CSC(C)C(=O)N1CCC(F)(F)CC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
HPGD P15428 1/20 0.37
EPHX2 P34913 2/20 0.33
CYP2D6 P10635 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PDE9A O76083 1/20 0.32
POLB P06746 2/20 0.31
CYP1A2 P05177 3/20 0.31
CYP2C9 P11712 2/20 0.31
FPR2 P25090 1/20 0.30
PIK3CD O00329 2/20 0.30
PIK3R1 P27986 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
SCHEMBL20417264 0.81 HPGD (0.47) HPGDALDH1A1MEN1KMT2APOLB
SCHEMBL2739925 0.81 DPP4 (0.41) DPP4DPP7EPHX2ALDH1A1MEN1
SCHEMBL30943584 0.79 HPGD (0.50) DPP4DPP7HPGDALDH1A1MEN1
SCHEMBL19578176 0.76 SMN1; SMN2 (0.47) HPGDALDH1A1MEN1KMT2A
SCHEMBL21310237 0.74 DPP4 (0.44) DPP4DPP7
SCHEMBL20970568 0.73 HRH3 (0.39) DPP4DPP7CYP2D6ALDH1A1
SCHEMBL15203488 0.72 DPP4 (0.43) DPP4DPP7
SCHEMBL3434463 0.72 EPHX2 (0.55) HPGDEPHX2CYP2D6ALDH1A1MEN1
SCHEMBL27812244 0.71 ALDH1A1 (0.43) DPP4DPP7HPGDEPHX2ALDH1A1
SCHEMBL19704613 0.71 HRH3 (0.53) HPGDEPHX2CYP2D6ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219975-A1 PYRIDO[2,3-B][1,4]OXAZINES OR TETRAHYDROPYRIDO[2,3-B][1,4]OXAZEPINES AS IAP ANTAGONISTS BEONE MEDICINES I GMBH (CH) 2023-07-13 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-20230219975-A1 PYRIDO[2,3-B][1,4]OXAZINES OR TETRAHYDROPYRIDO[2,3-B][1,4]OXAZEPINES AS IAP ANTAGONISTS BIRC2, BIRC3, API5 DPP4 1884/4885DPP7 2007/4885HPGD 921/4885

“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.