SCHEMBL29671571

SCHEMBL29671571

c1ccc(N2CCN(c3cscn3)CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.52
▸ LMNA P02545 4/20 0.52
▸ ALDH1A1 P00352 3/20 0.51
▸ RAB9A P51151 3/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ GAA P10253 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ NFKB1 P19838 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ NFKB2 Q00653 1/20 0.51
▸ RELA Q04206 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ SORD Q00796 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46
▸ KMT2A Q03164 3/20 0.45
▸ KCNH2 Q12809 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ CHRNA7 P36544 1/20 0.43

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
SCHEMBL29671544 0.78 DHFR (0.46) MAPTRAB9ANPC1HPGDSMN1; SMN2
SCHEMBL11922648 0.78 HRH3 (0.40) MAPTLMNAALDH1A1RAB9ANPC1
SCHEMBL6627984 0.77 HRH4 (0.43) ALDH1A1KDM4EHTR3EHTR3BHTR3A
SCHEMBL17927473 0.76 PIM1 (0.40) MAPTLMNAALDH1A1RAB9ANPC1
SCHEMBL2344598 0.75 GRM5 (0.49) LMNAALDH1A1RAB9AMAPK1
Bromide SCHEMBL16992410 0.75 PIM1 (0.39) MAPTLMNAALDH1A1RAB9ANPC1
SCHEMBL576814 0.74 LMNA (0.67) MAPTLMNAALDH1A1RAB9AGAA
SCHEMBL385012 0.74 — —
SCHEMBL576454 0.74 LMNA (0.67) MAPTLMNAALDH1A1RAB9AGAA
SCHEMBL164538 0.74 LMNA (0.67) MAPTLMNAALDH1A1RAB9AGAA

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-20220153732-A1 PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-05-19 — — 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-20220153732-A1 PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G MAPT 2487/4885LMNA 3715/4885ALDH1A1 4817/4885

“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.

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