SCHEMBL17844211

SCHEMBL17844211

CC(C)(C)n1sc(-c2ccccc2)c(NC2CCN(C(=O)Cc3ccccc3)CC2)c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 3/20 0.42
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
HSD11B1 P28845 1/20 0.42
TSHR P16473 1/20 0.41
POLB P06746 2/20 0.40
TACR3 P29371 1/20 0.40
HRH3 Q9Y5N1 2/20 0.40
MEN1 O00255 1/20 0.39

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
SCHEMBL17844237 0.87 PTPN1 (0.41) POLBTP53
SCHEMBL17844179 0.85 MEN1 (0.47) ALDH1A1POLBMEN1KMT2A
SCHEMBL17844153 0.84 MAPK8 (0.41) L3MBTL1ALDH1A1POLBTACR3MEN1
SCHEMBL17844249 0.84 ACHE (0.50) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL17844164 0.82 KAT2B (0.38) HDAC1POLB
SCHEMBL17844160 0.82 SIGMAR1 (0.45) ALDH1A1MEN1KMT2A
SCHEMBL17844268 0.77 POLB (0.47) ALDH1A1TSHRPOLBKMT2A
SCHEMBL17844219 0.73 CKS1B (0.38) HRH3
SCHEMBL5260026 0.72 GPR119 (0.38)
SCHEMBL1999147 0.72 NR1H2 (0.47) L3MBTL1ALDH1A1KDM4EHDAC3HDAC4

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 L3MBTL1 1467/4885ALDH1A1 1591/4885KDM4E 1602/4885
US-20190029984-A1 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS NR1H3, NR1H2, MCL1 L3MBTL1 1467/4885ALDH1A1 1591/4885KDM4E 1602/4885

“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.