SCHEMBL17844178

SCHEMBL17844178

CC(C)(C)n1sc(-c2ccccc2)c(NCCCOc2ccc(Cl)cc2)c1=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 6/20 0.43
DRD2 P14416 5/20 0.43
DRD3 P35462 4/20 0.43
RXFP1 Q9HBX9 2/20 0.39
MAPT P10636 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TAAR1 Q96RJ0 1/20 0.38
TSHR P16473 1/20 0.38
POLB P06746 1/20 0.37
GPR84 Q9NQS5 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL17844223 0.97 DRD2 (0.41) DRD4DRD2DRD3RXFP1MAPT
SCHEMBL17844236 0.91 DRD2 (0.44) DRD4DRD2DRD3MEN1KMT2A
SCHEMBL17844180 0.90 KDM4E (0.37) RXFP1MAPTMEN1KMT2APOLB
SCHEMBL17844246 0.90 HCRTR1 (0.39) DRD4DRD2DRD3MEN1KMT2A
SCHEMBL5186747 0.89 PTPN2 (0.37) DRD4DRD2DRD3POLBGPR84
SCHEMBL17844247 0.89 HTR1B (0.39) DRD4DRD2DRD3MAPTMEN1
SCHEMBL17844230 0.89 DRD2 (0.46) DRD4DRD2RXFP1MAPTMEN1
SCHEMBL5184340 0.88 GBA1 (0.35) MEN1KMT2ATSHRGPR84L3MBTL1
SCHEMBL17844130 0.85 DRD2 (0.41) DRD4DRD2DRD3MAPTMEN1
SCHEMBL17844232 0.84 DRD2 (0.44) DRD4DRD2DRD3GPR84KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230338314-A1 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS THE ROCKEFELLER UNIVERSITY (US) 2023-10-26 US disclosed
US-11648220-B2 Methods for the treatment of myeloid derived suppressor cells related disorders THE ROCKEFELLER UNIVERSITY (US) 2023-05-16 US disclosed
US-20190125745-A1 TREATMENT AND DIAGNOSIS OF CANCER RGENIX, INC. 2019-05-02 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-2018222975-A1 METHODS FOR THE TREATMENT OF CANCER RGENIX, INC. (US) 2018-12-06 WO disclosed
EP-3402477-A2 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS The Rockefeller University (US) 2018-11-21 EP disclosed
WO-2017123568-A2 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS THE ROCKEFELLER UNIVERSITY (US) 2017-07-20 WO 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 (4 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 DRD4 4817/4885DRD2 4788/4885DRD3 4657/4885
US-20230338314-A1 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS NR1H3, NR1H2, MCL1 DRD4 4817/4885DRD2 4788/4885DRD3 4657/4885
US-20190029984-A1 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS NR1H3, NR1H2, MCL1 DRD4 4817/4885DRD2 4788/4885DRD3 4657/4885
US-20190125745-A1 TREATMENT AND DIAGNOSIS OF CANCER NR1H4, NR1H3, NR1H2 DRD4 3819/4885DRD2 3454/4885DRD3 3656/4885

“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.