SCHEMBL24937779

SCHEMBL24937779

O=C(N1CCN(c2nccs2)CC1)n1nccn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.54
GRM1 Q13255 1/20 0.54
SLC6A7 Q99884 1/20 0.53
SCD O00767 1/20 0.51
HRH3 Q9Y5N1 1/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
MEN1 O00255 1/20 0.43
CTSB P07858 1/20 0.42
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
HTT P42858 1/20 0.41
ALDH1A1 P00352 2/20 0.40
DRD2 P14416 1/20 0.40
SLC27A1 Q6PCB7 1/20 0.39
SPR P35270 1/20 0.39
AOC3 Q16853 1/20 0.38
KDM4C Q9H3R0 1/20 0.37

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
SCHEMBL27722988 0.89 GRM5 (0.61) GRM5GRM1SLC6A7SCDHRH3
SCHEMBL3844701 0.81 SLC6A7 (0.62) GRM5GRM1SLC6A7SCDHRH3
SCHEMBL5987878 0.80 GRM5 (0.58) GRM5GRM1SLC6A7SCDHRH3
SCHEMBL11067902 0.80 GRM5 (0.58) GRM5GRM1SLC6A7SCDHRH3
SCHEMBL24937193 0.78 GRM5 (0.51) GRM5GRM1SLC6A7SCDHRH3
SCHEMBL29102030 0.78
SCHEMBL18701819 0.76 GRM5 (0.54) GRM5GRM1SLC6A7SCDHRH3
SCHEMBL5178383 0.76 GRM5 (0.54) GRM5GRM1SLC6A7SCDHRH3
SCHEMBL3146878 0.76 GRM5 (0.54) GRM5GRM1SLC6A7SCDHRH3
SCHEMBL11071509 0.76 GRM5 (0.54) GRM5GRM1SLC6A7SCDHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230024778-A1 STRIGOLACTONE RECEPTOR INHIBITOR, AGRICULTURAL COMPOSITION AND USE THEREOF, STRIGA SEED GERMINATION INHIBITOR, AND TRIAZOLE UREA COMPOUND THE UNIVERSITY OF TOKYO (JP) 2023-01-26 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-20230024778-A1 STRIGOLACTONE RECEPTOR INHIBITOR, AGRICULTURAL COMPOSITION AND USE THEREOF, STRIGA SEED GERMINATION INHIBITOR, AND TRIAZOLE UREA COMPOUND UTS2R, TAS1R1, ULK3 GRM5 511/4885GRM1 288/4885SLC6A7 3817/4885

“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.