SCHEMBL25390954

SCHEMBL25390954

Nc1nc([C@H]2CCCN(c3ccccn3)C2)cs1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAP4K4 O95819 9/20 0.51
▸ NPC1 O15118 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ DGAT2 Q96PD7 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.39
▸ BTK Q06187 1/20 0.39
▸ CYP11B2 P19099 1/20 0.39
▸ KAT2B Q92831 1/20 0.38

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
SCHEMBL25392655 1.00 MAP4K4 (0.51) MAP4K4NPC1LMNATP53MAPT
SCHEMBL25390958 1.00 MAP4K4 (0.51) MAP4K4NPC1LMNATP53MAPT
SCHEMBL25393063 0.93 NPC1 (0.46) MAP4K4NPC1LMNATP53MAPT
SCHEMBL25393059 0.93 NPC1 (0.46) MAP4K4NPC1LMNATP53MAPT
SCHEMBL25394959 0.93 NPC1 (0.46) MAP4K4NPC1LMNATP53MAPT
SCHEMBL25391714 0.79 RAB9A (0.46) NPC1LMNATP53MAPTMAPK1
SCHEMBL18129029 0.75 MAP4K4 (0.57) MAP4K4DGAT2CYP11B2KAT2B
SCHEMBL23730026 0.72 RAB9A (0.46) MAP4K4LMNAMAPTRAB9AHSD17B10
SCHEMBL29683665 0.72 PRKCQ (0.53) MAP4K4KAT2B
SCHEMBL723065 0.72 PRKCQ (0.53) MAP4K4KAT2B

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-20230286973-A1 PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2023-09-14 — — 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-20230286973-A1 PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G MAP4K4 2259/4885NPC1 369/4885LMNA 3751/4885

“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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