SCHEMBL25757793

SCHEMBL25757793

COc1c(NC(=O)OC(C)(C)C)ccn2ncc(I)c12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.34
IDO1 P14902 2/20 0.33
EPHB3 P54753 2/20 0.33
BRD9 Q9H8M2 1/20 0.33
ATR Q13535 1/20 0.33
DGAT1 O75907 1/20 0.33
IRAK4 Q9NWZ3 3/20 0.33
GSK3B P49841 1/20 0.33
DYRK1A Q13627 1/20 0.33
PCSK9 Q8NBP7 1/20 0.33
METAP1 P53582 1/20 0.32
NAMPT P43490 1/20 0.32
PIK3CD O00329 1/20 0.32
ABL1 P00519 1/20 0.32
EGFR P00533 1/20 0.32
KDR P35968 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CG P48736 1/20 0.32
BACE1 P56817 1/20 0.32
PRKDC P78527 1/20 0.32

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
SCHEMBL30895110 0.87 DGAT1 (0.35) IDO1EPHB3BRD9ATRDGAT1
SCHEMBL30895038 0.87 ITGA4 (0.36) NR1I2IDO1BRD9ATRDGAT1
SCHEMBL25757792 0.85 ATR (0.35) IDO1EPHB3BRD9ATRDGAT1
SCHEMBL25757841 0.85 ATR (0.35) IDO1EPHB3BRD9ATRDGAT1
SCHEMBL25757107 0.85 ATR (0.42) IDO1EPHB3BRD9ATRDGAT1
SCHEMBL30895044 0.85 PCSK9 (0.36) IDO1BRD9ATRDGAT1IRAK4
SCHEMBL25757532 0.84 PCSK9 (0.36) IDO1BRD9ATRDGAT1IRAK4
SCHEMBL25757796 0.84 DGAT1 (0.43) IDO1DGAT1GSK3BDYRK1AMETAP1
SCHEMBL25757842 0.84 IDO1 (0.37) IDO1BRD9ATRDGAT1GSK3B
SCHEMBL27199432 0.84 IRAK4 (0.37) EPHB3IRAK4MAPT

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-20250115597-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO LTD (CN) 2025-04-10 US disclosed
US-12129250-B2 TYK2 inhibitors and compositions and methods thereof LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-10-29 US disclosed
CN-118401516-A TYK2 inhibitors, compositions and methods thereof 凌科药业(杭州)有限公司 2024-07-26 CN disclosed
US-20240124448-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-04-18 US disclosed
WO-2023109954-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-06-22 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-20240124448-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF TYK2, JAK2, JAK1 NR1I2 3208/4885IDO1 570/4885EPHB3 1493/4885
US-20250115597-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF TYK2, JAK2, JAK1 NR1I2 3208/4885IDO1 570/4885EPHB3 1493/4885
US-12129250-B2 TYK2 inhibitors and compositions and methods thereof TYK2, JAK2, JAK1 NR1I2 3208/4885IDO1 570/4885EPHB3 1493/4885

“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.