SCHEMBL23535734

SCHEMBL23535734

Cc1nn(COCC[Si](C)(C)C)c2ccc(C(N)=O)cc12

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.59
KMT2A Q03164 1/20 0.38
NAMPT P43490 1/20 0.37
JAK2 O60674 3/20 0.35
JAK1 P23458 3/20 0.35
TYK2 P29597 3/20 0.35
JAK3 P52333 3/20 0.35
PTGER4 P35408 1/20 0.35
KLKB1 P03952 1/20 0.35
KDM4E B2RXH2 1/20 0.35
BRD4 O60885 1/20 0.35
ALDH1A1 P00352 1/20 0.35
BRPF1 P55201 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35
SLC22A12 Q96S37 2/20 0.34
LMNA P02545 1/20 0.34
PTPN1 P18031 1/20 0.33
DGAT1 O75907 1/20 0.33

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
SCHEMBL30159685 1.00 NPC1 (0.59) NPC1KMT2ANAMPTJAK2JAK1
SCHEMBL29612533 0.82 NPC1 (0.38) NPC1KMT2AALDH1A1HSD17B10LMNA
SCHEMBL19023399 0.82 NPC1 (0.38) NPC1KMT2AALDH1A1HSD17B10LMNA
SCHEMBL14493341 0.81 ADORA2A (0.37) NPC1NAMPTKDM4EALDH1A1HSD17B10
SCHEMBL31086380 0.80 NPC1 (0.51) NPC1NAMPTPTGER4
SCHEMBL4312796 0.79 DGAT1 (0.43) NPC1KDM4EHSD17B10LMNADGAT1
SCHEMBL28730646 0.79 NPC1 (0.36) NPC1DGAT1
SCHEMBL3644842 0.78 NPC1 (0.54) NPC1KMT2ANAMPTJAK2JAK1
SCHEMBL14699371 0.77 NPC1 (0.54) NPC1
SCHEMBL4310521 0.76 DGAT1 (0.35) NPC1PTGER4KDM4EBRD4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230027198-A1 INHIBITORS OF ENL/AF9 YEATS THE ROCKEFELLER UNIVERSITY 2023-01-26 US disclosed
US-20230027198-A1 INHIBITORS OF ENL/AF9 YEATS THE ROCKEFELLER UNIVERSITY 2023-01-26 US disclosed
EP-4076440-A1 INHIBITORS OF ENL/AF9 YEATS The Rockefeller University (US) 2022-10-26 EP disclosed
WO-2021127166-A1 INHIBITORS OF ENL/AF9 YEATS THE ROCKEFELLER UNIVERSITY (US) 2021-06-24 WO disclosed
WO-2021127166-A1 INHIBITORS OF ENL/AF9 YEATS THE ROCKEFELLER UNIVERSITY (US) 2021-06-24 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 (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-20230027198-A1 INHIBITORS OF ENL/AF9 YEATS MLLT3, YEATS2, MLLT1 NPC1 3378/4885KMT2A 27/4885NAMPT 794/4885

“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.