SCHEMBL16407939

SCHEMBL16407939

CCc1c(F)cc(-c2ccc(-n3cc(C(C)(C)O)nc3C(C)(C)c3cccc(F)c3Cl)cc2)cc1S(C)(=O)=O

nearest known ligand 0.91

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RXRA P19793 19/20 0.91
NR1H2 P55055 19/20 0.91
NR1H3 Q13133 19/20 0.91
NR1I2 O75469 2/20 0.91
PTGS2 P35354 1/20 0.38

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
SCHEMBL30197815 0.95 NR1H2 (1.00) RXRANR1H2NR1H3NR1I2
SCHEMBL779338 0.95 NR1H2 (1.00) RXRANR1H2NR1H3NR1I2
SCHEMBL16407945 0.92 RXRA (0.89) RXRANR1H2NR1H3NR1I2PTGS2
SCHEMBL16407950 0.89 RXRA (0.89) RXRANR1H2NR1H3NR1I2
SCHEMBL781718 0.86 NR1H2 (1.00) RXRANR1H2NR1H3NR1I2
SCHEMBL15783180 0.83 RXRA (0.87) RXRANR1H2NR1H3NR1I2PTGS2
SCHEMBL779391 0.83 RXRA (1.00) RXRANR1H2NR1H3NR1I2
SCHEMBL16407940 0.83 NR1H2 (0.77) RXRANR1H2NR1H3NR1I2
SCHEMBL16407947 0.83 NR1H2 (0.89) RXRANR1H2NR1H3NR1I2
SCHEMBL16407956 0.81 RXRA (0.89) RXRANR1H2NR1H3NR1I2

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 11 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-20180153833-A1 TREATMENT AND DIAGNOSIS OF MELANOMA THE ROCKEFELLER UNIVERSITY (US) 2018-06-07 US disclosed
US-9962348-B2 Treatment and diagnosis of melanoma THE ROCKEFELLER UNIVERSITY (US) 2018-05-08 US disclosed
US-20170319525-A1 TREATMENT AND DIAGNOSIS OF MELANOMA THE ROCKEFELLER UNIVERSITY (US) 2017-11-09 US disclosed
US-9707195-B2 Treatment and diagnosis of melanoma THE ROCKEFELLER UNIVERSITY (US) 2017-07-18 US disclosed
US-9526710-B2 Treatment and diagnosis of melanoma THE ROCKEFELLER UNIVERSITY (US) 2016-12-27 US disclosed
US-20160331726-A1 TREATMENT AND DIAGNOSIS OF MELANOMA THE ROCKEFELLER UNIVERSITY (US) 2016-11-17 US disclosed
US-9399028-B2 Treatment of drug resistant cancer THE ROCKEFELLER UNIVERSITY (US) 2016-07-26 US disclosed
US-20150073053-A1 TREATMENT OF DRUG RESISTANT CANCER ROCKEFELLER UNIVERSITY (THE) (US) 2015-03-12 US disclosed
US-20150023955-A1 Treatment and Diagnosis of Melanoma THE ROCKEFELLER UNIVERSITY (US) 2015-01-22 US 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 (7 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-20170319525-A1 TREATMENT AND DIAGNOSIS OF MELANOMA EYA3, BRAF, CD99 RXRA 2268/4885NR1H2 4537/4885NR1H3 4400/4885
US-11648220-B2 Methods for the treatment of myeloid derived suppressor cells related disorders NR1H3, NR1H2, MCL1 RXRA 20/4885NR1H2 2/4885NR1H3 1/4885
US-20230338314-A1 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS NR1H3, NR1H2, MCL1 RXRA 20/4885NR1H2 2/4885NR1H3 1/4885
US-20150073053-A1 TREATMENT OF DRUG RESISTANT CANCER ABCC1, TSG101, NTPCR RXRA 2119/4885NR1H2 3830/4885NR1H3 3331/4885
US-20160331726-A1 TREATMENT AND DIAGNOSIS OF MELANOMA EYA3, BRAF, CD99 RXRA 2268/4885NR1H2 4537/4885NR1H3 4400/4885
US-20180153833-A1 TREATMENT AND DIAGNOSIS OF MELANOMA EYA3, BRAF, CD99 RXRA 2268/4885NR1H2 4537/4885NR1H3 4400/4885
US-20150023955-A1 Treatment and Diagnosis of Melanoma EYA3, BRAF, CD99 RXRA 2268/4885NR1H2 4537/4885NR1H3 4400/4885

“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.