SCHEMBL14213173

SCHEMBL14213173

Oc1nsc(N2CCCCCC2)n1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.38
HSD17B10 Q99714 3/20 0.38
GAA P10253 2/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 9/20 0.35
TP53 P04637 2/20 0.35
ALOX15 P16050 2/20 0.35
AR P10275 1/20 0.35
DPP4 P27487 2/20 0.34
RAB9A P51151 6/20 0.33
NPC1 O15118 5/20 0.33
HPGD P15428 3/20 0.33
TSHR P16473 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33

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
SCHEMBL12019703 1.00 ALDH1A1 (0.38) ALDH1A1HSD17B10GAAMAPK1SMN1; SMN2
SCHEMBL12019485 0.98 ALDH1A1 (0.35) ALDH1A1HSD17B10GAAMAPK1SMN1; SMN2
SCHEMBL19557739 0.80 FAAH (0.31) RAB9ANPC1
SCHEMBL14213055 0.80 NPC1 (0.46) ALDH1A1GAASMN1; SMN2TP53ALOX15
SCHEMBL12453031 0.75 DPP4 (0.48) ALDH1A1HSD17B10GAAMAPK1SMN1; SMN2
SCHEMBL14213358 0.72 MAP4K4 (0.42) GAA
SCHEMBL23083016 0.71 DPP4 (0.50) ALDH1A1HSD17B10GAAMAPK1SMN1; SMN2
SCHEMBL19399060 0.71 CHRM3 (0.47)
SCHEMBL11472207 0.71 DPP4 (0.39) ALDH1A1HSD17B10GAAMAPK1SMN1; SMN2
SCHEMBL11464167 0.71 DPP4 (0.39) ALDH1A1HSD17B10GAAMAPK1SMN1; SMN2

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-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 248/4885HSD17B10 1490/4885GAA 3746/4885

“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.