SCHEMBL4853705

SCHEMBL4853705

CSc1nsc(N2CCCC2)n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.35
MAPT P10636 5/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 2/20 0.35
POLB P06746 1/20 0.35
FAAH O00519 1/20 0.34
NPC1 O15118 6/20 0.33
RAB9A P51151 6/20 0.33
MAPK1 P28482 3/20 0.33
TSHR P16473 3/20 0.33
DPP4 P27487 2/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 3/20 0.32
GAA P10253 2/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 2/20 0.32
HPGD P15428 2/20 0.32
ALOX15 P16050 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL4850781 0.76 MAP4K4 (0.37) GAA
SCHEMBL4854139 0.75 KMT2A (0.31) KMT2A
SCHEMBL12453031 0.72 DPP4 (0.48) ALDH1A1NPC1RAB9AMAPK1TSHR
SCHEMBL12019485 0.69 ALDH1A1 (0.35) ALDH1A1MAPTLMNANPC1RAB9A
SCHEMBL14213173 0.68 ALDH1A1 (0.38) ALDH1A1NPC1RAB9AMAPK1TSHR
SCHEMBL12019703 0.68 ALDH1A1 (0.38) ALDH1A1NPC1RAB9AMAPK1TSHR
SCHEMBL23083016 0.68 DPP4 (0.50) ALDH1A1KMT2ANPC1RAB9AMAPK1
SCHEMBL4850565 0.67 DPP4 (0.34) ALDH1A1MAPK1TSHRDPP4SMN1; SMN2
SCHEMBL4850584 0.67 ALDH1A1 (0.36) ALDH1A1NPC1RAB9AMAPK1TSHR
SCHEMBL4472198 0.66 HRH4 (0.43) ALDH1A1KMT2ASMN1; SMN2HTTMEN1

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 248/4885MAPT 3112/4885KMT2A 3742/4885

“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.