SCHEMBL25394959

SCHEMBL25394959

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.46
▸ RAB9A P51151 5/20 0.46
▸ MAPT P10636 3/20 0.46
▸ LMNA P02545 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ AVPR1A P37288 6/20 0.43
▸ MAP4K4 O95819 1/20 0.43
▸ HK1 P19367 1/20 0.40
▸ HKDC1 Q2TB90 1/20 0.40
▸ CYP1A2 P05177 3/20 0.39
▸ CYP2C9 P11712 3/20 0.39
▸ CYP2C19 P33261 3/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMPD3 Q9NY59 1/20 0.39
▸ CYP3A4 P08684 1/20 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
SCHEMBL25393063 1.00 NPC1 (0.46) NPC1RAB9AMAPTLMNATP53
SCHEMBL25393059 1.00 NPC1 (0.46) NPC1RAB9AMAPTLMNATP53
SCHEMBL25390954 0.93 MAP4K4 (0.51) NPC1RAB9AMAPTLMNATP53
SCHEMBL25392655 0.93 MAP4K4 (0.51) NPC1RAB9AMAPTLMNATP53
SCHEMBL25390958 0.93 MAP4K4 (0.51) NPC1RAB9AMAPTLMNATP53
SCHEMBL25391714 0.81 RAB9A (0.46) NPC1RAB9AMAPTLMNATP53
SCHEMBL28690827 0.74 NPC1 (0.53) NPC1RAB9AMAPTMAP4K4CYP1A2
SCHEMBL27832374 0.73 MAPT (0.67) NPC1RAB9AMAPTLMNATP53
SCHEMBL9343656 0.71 RAB9A (0.48) RAB9AMAPTLMNASMN1; SMN2MEN1
SCHEMBL3658830 0.70 HRH4 (0.51) AVPR1ACYP1A2MEN1KMT2A

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 NPC1 369/4885RAB9A 277/4885MAPT 2824/4885

“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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