SCHEMBL29167802

SCHEMBL29167802

O=C(N[C@@H]1CCOC1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 10/20 0.61
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
KDM1A O60341 1/20 0.50
HPGDS O60760 1/20 0.49
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
CTSK P43235 1/20 0.48

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
SCHEMBL13868569 1.00 NAMPT (0.61) NAMPTNPC1RAB9AMEN1KMT2A
SCHEMBL633936 1.00 NAMPT (0.61) NAMPTNPC1RAB9AMEN1KMT2A
SCHEMBL364174 0.90 NPC1 (0.62) NAMPTNPC1RAB9AMEN1KMT2A
Water SCHEMBL30838095 0.88 NPC1 (0.60) NAMPTNPC1RAB9AMEN1KMT2A
SCHEMBL12505662 0.86 NPC1 (0.56) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL14797411 0.84 NAMPT (0.52) NAMPTNPC1RAB9AMEN1KMT2A
SCHEMBL27962735 0.83 KDM1A (0.54) NAMPTNPC1RAB9AKDM1AHPGDS
SCHEMBL30968148 0.83 ALDH1A1 (0.52) NAMPTNPC1RAB9AMEN1KMT2A
SCHEMBL30968047 0.83 ALDH1A1 (0.52) NAMPTNPC1RAB9AMEN1KMT2A
SCHEMBL23387883 0.82 ALDH1A1 (0.59) NAMPTRAB9ASMN1; SMN2HPGDSALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117647598-A High performance liquid analysis method for enantiomer of (S) -3-amino tetrahydrofuran and intermediate 上海司太立制药有限公司 2024-03-05 CN claimed
US-20240400564-A1 INHIBITORS OF THE MENIN-MLL INTERACTION SYNDAX PHARMACEUTICALS, INC. 2024-12-05 US disclosed
CN-117956992-A MENIN-MLL interaction inhibitors 赛达克斯制药股份有限公司 2024-04-30 CN disclosed
EP-4337203-A1 INHIBITORS OF THE MENIN-MLL INTERACTION Syndax Pharmaceuticals, Inc. (US) 2024-03-20 EP disclosed
CN-117647598-A High performance liquid analysis method for enantiomer of (S) -3-amino tetrahydrofuran and intermediate 上海司太立制药有限公司 2024-03-05 CN disclosed
US-11919901-B2 Inhibitors of the menin-MLL interaction SYNDAX PHARMACEUTICALS, INC. (US) 2024-03-05 US disclosed
US-20230021684-A1 INHIBITORS OF THE MENIN-MLL INTERACTION SYNDAX PHARMACEUTICALS, INC. 2023-01-26 US disclosed
WO-2022241265-A1 INHIBITORS OF THE MENIN-MLL INTERACTION SYNDAX PHARMACEUTICALS, INC. (US) 2022-11-17 WO 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 (3 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-11919901-B2 Inhibitors of the menin-MLL interaction MLLT1, MEN1, MLLT3 NAMPT 1760/4885NPC1 2910/4885RAB9A 1287/4885
US-20240400564-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 NAMPT 1744/4885NPC1 2965/4885RAB9A 1297/4885
US-20230021684-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 NAMPT 1744/4885NPC1 2965/4885RAB9A 1297/4885

“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.