SCHEMBL17844147

SCHEMBL17844147

CC(C)n1sc(-c2ccccc2)c(NC2CCC(F)(F)CC2)c1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.35
PDE4B Q07343 1/20 0.34
PDE7A Q13946 1/20 0.34
MAPK1 P28482 3/20 0.33
IDH1 O75874 6/20 0.33
WHR1 P49842 1/20 0.32
FFAR2 O15552 1/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPK8 P45983 1/20 0.32
BCDIN3D Q7Z5W3 1/20 0.32
JAK1 P23458 1/20 0.31
JAK3 P52333 1/20 0.31
IDH2 P48735 1/20 0.31

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
SCHEMBL17844241 0.85 MAPK10 (0.42) PDE4BPDE7AMAPK1MEN1USP2
SCHEMBL17844225 0.85 MAPK10 (0.42) PDE4BPDE7AMAPK1MEN1USP2
SCHEMBL2000938 0.70 GBA1 (0.35) GBA1MAPK1IDH1WHR1FFAR2
SCHEMBL5185900 0.67 KAT2B (0.36) MEN1MAPTHTTKMT2AL3MBTL1
SCHEMBL28868824 0.67 GBA1 (0.36) GBA1MAPK1IDH1WHR1FFAR2
SCHEMBL17844146 0.66 HTR1B (0.39) MAPTL3MBTL1
SCHEMBL17844164 0.66 KAT2B (0.38) MAPK1
SCHEMBL5184355 0.66 BRD4 (0.36) MAPK1USP2MAPK8BRD4
SCHEMBL17844153 0.65 MAPK8 (0.41) MAPK1MEN1MAPTHTTKMT2A
SCHEMBL31303190 0.64 IDH1 (0.43) GBA1IDH1FFAR2MEN1MAPT

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 GBA1 807/4885PDE4B 2138/4885PDE7A 2340/4885
US-20190029984-A1 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS NR1H3, NR1H2, MCL1 GBA1 807/4885PDE4B 2138/4885PDE7A 2340/4885

“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.