SCHEMBL12019485

SCHEMBL12019485

Oc1nsc(N2CCCC2)n1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.35
GAA P10253 2/20 0.35
HSD17B10 Q99714 2/20 0.35
MAPK1 P28482 2/20 0.35
DPP4 P27487 3/20 0.35
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 6/20 0.33
NPC1 O15118 4/20 0.33
SMN1; SMN2 Q16637 6/20 0.33
TP53 P04637 2/20 0.33
AR P10275 1/20 0.33
ALOX15 P16050 1/20 0.33
GALR3 O60755 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL14213173 0.98 ALDH1A1 (0.38) ALDH1A1GAAHSD17B10MAPK1DPP4
SCHEMBL12019703 0.98 ALDH1A1 (0.38) ALDH1A1GAAHSD17B10MAPK1DPP4
SCHEMBL14213055 0.82 NPC1 (0.46) ALDH1A1GAALMNARAB9ANPC1
SCHEMBL19557739 0.82 FAAH (0.31) RAB9ANPC1
SCHEMBL14213358 0.74 MAP4K4 (0.42) GAA
SCHEMBL12453031 0.72 DPP4 (0.48) ALDH1A1GAAHSD17B10MAPK1DPP4
SCHEMBL14213354 0.71 ALDH1A1 (0.49) ALDH1A1GAALMNAHPGDTSHR
SCHEMBL11461830 0.69 DPP4 (0.40) ALDH1A1GAAHSD17B10MAPK1DPP4
SCHEMBL4853705 0.69 ALDH1A1 (0.35) ALDH1A1GAAHSD17B10MAPK1DPP4
SCHEMBL23083016 0.68 DPP4 (0.50) ALDH1A1GAAHSD17B10MAPK1DPP4

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
EP-2492265-A1 1,2,4-Thiadiazole Compounds and Pests Controlling Composition Containing the same Sumitomo Chemical Company, Limited (JP) 2012-08-29 EP disclosed
US-7371746-B2 1,2,4-Thiadiazole compounds and pests controlling composition containing the same SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2008-05-13 US disclosed
US-20070004722-A1 1,2,4-Thiadazole compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-01-04 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-20070004722-A1 1,2,4-Thiadazole compounds and use thereof CYP4F3, CYP4B1, CYP4X1 ALDH1A1 248/4885GAA 3746/4885HSD17B10 1490/4885

“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.