SCHEMBL6502963

SCHEMBL6502963

CC1(C)C(NC2=NC(=O)C(CC(=O)N3Cc4ccccc4C3)S2)C1(C)C

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP9 Q86TI2 6/20 0.37
DPP8 Q6V1X1 5/20 0.37
GLMN Q92990 1/20 0.37
NAMPT P43490 4/20 0.35
CALCRL Q16602 5/20 0.35
TSHR P16473 2/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NOTUM Q6P988 1/20 0.35
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL6507694 0.82 ALDH1A1 (0.46) DPP9DPP8NAMPTCALCRLMAPT
SCHEMBL6426012 0.81 TSHR (0.50) TSHRMAPTHTTNPSR1ALDH1A1
SCHEMBL6428167 0.81 HSP90AA1 (0.39) DPP9DPP8GLMNNAMPTTSHR
SCHEMBL6430640 0.80 ALDH1A1 (0.40) TSHRMAPTHTTNPSR1ALDH1A1
SCHEMBL6428776 0.78 ALDH1A1 (0.49) DPP8MAPTHTTNPSR1ALDH1A1
SCHEMBL6427696 0.78 DPP8 (0.34) DPP9DPP8GLMNNAMPTTSHR
SCHEMBL6393517 0.77 ALDH1A1 (0.55) DPP8MAPTHTTNPSR1ALDH1A1
SCHEMBL6500205 0.77 DPP9 (0.46) DPP9DPP8GLMNALDH1A1
SCHEMBL6386550 0.76 NAMPT (0.42) DPP9DPP8NAMPTMAPTALDH1A1
SCHEMBL6427188 0.76 ALDH1A1 (0.57) DPP8TSHRMAPTHTTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050239853-A1 New compounds BIOVITRUM AB (SE) 2005-10-27 US claimed
WO-2005075471-A2 THIAZOL-COMPOUNDS AS 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS BIOVITRUM AB (SE) 2005-08-18 WO claimed
US-20050239853-A1 New compounds BIOVITRUM AB (SE) 2005-10-27 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-20050239853-A1 New compounds HSD11B1, CYP11B1, HSD3B1 DPP9 1066/4885DPP8 1825/4885GLMN 4833/4885

“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.