SCHEMBL3559247

SCHEMBL3559247

COC1CCN(c2nc(C)cs2)CC1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.55
L3MBTL1 Q9Y468 1/20 0.42
DPP4 P27487 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
RAB9A P51151 3/20 0.39
OGA O60502 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
NPC1 O15118 2/20 0.39
MAP4K4 O95819 1/20 0.37

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
SCHEMBL13634185 0.91 HRH3 (0.50) HRH3L3MBTL1DPP4MAPTSMN1; SMN2
SCHEMBL13634230 0.87 HRH3 (0.55) HRH3L3MBTL1DPP4MAPTSMN1; SMN2
SCHEMBL13634292 0.83 HRH3 (0.52) HRH3L3MBTL1DPP4MAPTSMN1; SMN2
SCHEMBL10278217 0.82 HRH3 (0.48) HRH3L3MBTL1DPP4SMN1; SMN2RAB9A
SCHEMBL10136842 0.81 HRH3 (0.49) HRH3L3MBTL1DPP4SMN1; SMN2RAB9A
SCHEMBL13634266 0.80 HRH3 (0.46) HRH3MAPTSMN1; SMN2RAB9AOGA
SCHEMBL13634296 0.80 HRH3 (0.49) HRH3L3MBTL1DPP4MAPTSMN1; SMN2
SCHEMBL13999708 0.79 HRH3 (0.42) HRH3MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL13634365 0.78 HRH3 (0.47) HRH3L3MBTL1DPP4MAPTSMN1; SMN2
SCHEMBL3435877 0.78 HRH3 (0.52) HRH3SMN1; SMN2RAB9AOGANPC1

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-8163746-B2 Azolecarboxamide derivative ASTELLAS PHARMA INC. (JP) 2012-04-24 US disclosed
US-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-11-19 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 (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-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE GPR17, NTRK1, TRPV1 HRH3 338/4885L3MBTL1 3267/4885DPP4 1376/4885

“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.