SCHEMBL13200876

SCHEMBL13200876

CCOC(=O)Cn1ncc2nc(N3CCNCC3)n(Cc3ccccc3)c2c1=O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
TSHR P16473 2/20 0.54
ALDH1A1 P00352 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
DPP4 P27487 5/20 0.51
CHRM1 P11229 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
SOS1 Q07889 1/20 0.50
HTR3A P46098 1/20 0.49
NPC1 O15118 1/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL13217421 0.89 MEN1 (0.48) LMNATSHRALDH1A1NPSR1DPP4
Trifluoroacetic Acid SCHEMBL2965733 0.85 HTR3A (0.51) DPP4CHRM1SOS1HTR3AMAPT
SCHEMBL2965735 0.85 HTR3A (0.47) LMNATSHRDPP4CHRM1SOS1
SCHEMBL13200861 0.85 DPP4 (0.56) DPP4CHRM1SOS1HTR3A
SCHEMBL8352589 0.84 HTR3A (0.61) DPP4CHRM1SOS1HTR3A
SCHEMBL13200741 0.84 DPP4 (0.60) DPP4CHRM1MEN1KMT2A
Trifluoroacetic Acid SCHEMBL2952470 0.82 DPP4 (0.52) DPP4CHRM1SOS1HTR3AMAPT
SCHEMBL13200873 0.82 DPP4 (0.56) DPP4CHRM1SOS1HTR3A
SCHEMBL13200880 0.81 DPP4 (0.56) ALDH1A1DPP4CHRM1SOS1HTR3A
Trifluoroacetic Acid SCHEMBL2958554 0.81 DPP4 (0.49) ALDH1A1DPP4CHRM1SOS1HTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7772226-B2 Condensed imidazole derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-10 US disclosed
US-7772226-B2 Condensed imidazole derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-10 US disclosed
US-20090018331-A1 CONDENSED IMIDAZOLE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-01-15 US disclosed
US-20090018331-A1 CONDENSED IMIDAZOLE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-01-15 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-20090018331-A1 CONDENSED IMIDAZOLE DERIVATIVES DPP4, HDAC1, DPP7 LMNA 3909/4885TSHR 1385/4885ALDH1A1 686/4885

“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.