SCHEMBL29629679

SCHEMBL29629679

Cc1ncsc1COc1ccc2oc(C)c(C(=O)NC3CCNC3=O)c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
LMNA P02545 3/20 0.42
TSHR P16473 2/20 0.42
GAA P10253 2/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
ROCK1 Q13464 1/20 0.41
KMT2A Q03164 6/20 0.41
MEN1 O00255 5/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
KDM4E B2RXH2 1/20 0.41
SLC26A4 O43511 7/20 0.40
HPGDS O60760 2/20 0.40
BLM P54132 1/20 0.40
ATM Q13315 1/20 0.40
HTT P42858 1/20 0.40
POLB P06746 2/20 0.39

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
SCHEMBL24484795 1.00 MAPT (0.42) MAPTLMNATSHRGAACASP3
SCHEMBL29629882 0.94 RAB9A (0.43) MAPTLMNATSHRGAACASP3
SCHEMBL29629723 0.90 GAA (0.39) MAPTLMNATSHRGAACASP3
SCHEMBL24484873 0.90 GAA (0.39) MAPTLMNATSHRGAACASP3
SCHEMBL29629805 0.87 MAPT (0.42) MAPTLMNATSHRGAACASP3
SCHEMBL24484781 0.86 MAPT (0.42) MAPTLMNATSHRGAACASP3
SCHEMBL29630130 0.86 MAPT (0.42) MAPTLMNATSHRGAACASP3
SCHEMBL24485147 0.85 GAA (0.43) MAPTLMNATSHRGAACASP3
SCHEMBL30656136 0.85 HPGDS (0.40) HPGDS
Hydrochloric Acid SCHEMBL29095896 0.85 GAA (0.42) MAPTLMNATSHRGAACASP3

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-4251616-A1 HETEROCYCLE DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS Katholieke Universiteit Leuven (BE) 2023-10-04 EP claimed
WO-2022112352-A1 HETEROCYCLE DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2022-06-02 WO claimed
US-12209081-B2 Heterocycle derivatives for treating TRPM3 mediated disorders KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2025-01-28 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-12209081-B2 Heterocycle derivatives for treating TRPM3 mediated disorders TRPM4, TRPM6, TRPM2 MAPT 2911/4885LMNA 3056/4885TSHR 3289/4885

“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.