SCHEMBL14451978

SCHEMBL14451978

CNCc1c(C)nn(-c2ccccc2)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 1.00
KMT2A Q03164 1/20 1.00
NPC1 O15118 2/20 0.60
RAB9A P51151 2/20 0.60
TSHR P16473 1/20 0.56
P2RX7 Q99572 14/20 0.54
SMN1; SMN2 Q16637 1/20 0.53
ALOX15 P16050 1/20 0.49
HTT P42858 1/20 0.49

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
SCHEMBL13972844 0.84 MEN1 (0.72) MEN1KMT2ANPC1RAB9ATSHR
SCHEMBL14452035 0.83 MEN1 (0.70) MEN1KMT2ANPC1RAB9ATSHR
SCHEMBL14438321 0.83 MEN1 (0.70) MEN1KMT2ANPC1RAB9ATSHR
SCHEMBL13958930 0.83 MEN1 (0.70) MEN1KMT2ANPC1RAB9ATSHR
SCHEMBL12770960 0.81 MEN1 (0.68) MEN1KMT2ANPC1RAB9ATSHR
SCHEMBL11250227 0.79 MEN1 (0.66) MEN1KMT2ANPC1RAB9ATSHR
SCHEMBL2216798 0.79 MEN1 (0.65) MEN1KMT2ANPC1RAB9ATSHR
SCHEMBL11244177 0.79 MEN1 (0.65) MEN1KMT2ANPC1RAB9ATSHR
SCHEMBL12844535 0.78 NPC1 (0.68) MEN1KMT2ANPC1RAB9ATSHR
SCHEMBL23046929 0.77 MEN1 (0.62) MEN1KMT2ANPC1RAB9ATSHR

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-20070197522-A1 Dpp-iv inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2007-08-23 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-20070197522-A1 Dpp-iv inhibitors DPP7, DPP4, DPP3 MEN1 2811/4885KMT2A 3141/4885NPC1 1185/4885

“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.