SCHEMBL17844217

SCHEMBL17844217

CC(C)(C)n1sc(-c2ccccc2)c(NCCSc2cccc(OC(F)(F)F)c2)c1=O

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 1/20 0.36
PIM1 P11309 8/20 0.35
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
NOTUM Q6P988 1/20 0.33
TRPC5 Q9UL62 2/20 0.33
DYRK1A Q13627 1/20 0.33
ADK P55263 1/20 0.33
CETP P11597 1/20 0.32
KIF11 P52732 1/20 0.32
PIM2 Q9P1W9 2/20 0.32
STK17B O94768 1/20 0.32
GRM2 Q14416 1/20 0.32
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32
KCNH2 Q12809 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
SCHEMBL17844151 0.86 PIM1 (0.39) PIM1TRPC5DYRK1A
SCHEMBL17844139 0.79 FDPS (0.36) MTNR1AMTNR1BDRD2DRD3
SCHEMBL17844105 0.79 LTA4H (0.41)
SCHEMBL17844247 0.77 HTR1B (0.39) MTNR1AMTNR1BDRD2DRD3
SCHEMBL5306584 0.76 NTRK1 (0.38) GRM2DRD2
SCHEMBL17844169 0.76 SCN9A (0.36) DRD2
SCHEMBL5186747 0.75 PTPN2 (0.37) MTNR1AMTNR1BDRD2DRD3
SCHEMBL17844232 0.75 DRD2 (0.44) MTNR1AMTNR1BDRD2DRD3
SCHEMBL2001714 0.74 NR1H2 (0.40) CXCR2PIM1MTNR1AMTNR1BNOTUM
SCHEMBL17844230 0.74 DRD2 (0.46) DRD2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11648220-B2 Methods for the treatment of myeloid derived suppressor cells related disorders THE ROCKEFELLER UNIVERSITY (US) 2023-05-16 US disclosed
US-20190029984-A1 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS THE ROCKEFELLER UNIVERSITY (US) 2019-01-31 US disclosed
WO-2016100619-A2 TREATMENT AND DIAGNOSIS OF CANCER RGENIX, INC. (US) 2016-06-23 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 (2 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-11648220-B2 Methods for the treatment of myeloid derived suppressor cells related disorders NR1H3, NR1H2, MCL1 CXCR2 65/4885PIM1 1530/4885MTNR1A 1195/4885
US-20190029984-A1 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS NR1H3, NR1H2, MCL1 CXCR2 65/4885PIM1 1530/4885MTNR1A 1195/4885

“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.