SCHEMBL16557139

SCHEMBL16557139

CCc1c(F)cc(-c2ccc(-n3cc(C(C)(C)O)nc3Cc3ccccc3C(F)(F)F)c(F)c2)cc1S(C)(=O)=O

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 19/20 0.62
RXRA P19793 18/20 0.62
NR1H3 Q13133 18/20 0.62
NR1I2 O75469 2/20 0.54
F10 P00742 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
SCHEMBL782226 0.94 NR1H2 (0.67) NR1H2RXRANR1H3NR1I2F10
SCHEMBL16407943 0.94 NR1H2 (0.58) NR1H2RXRANR1H3NR1I2
SCHEMBL16407954 0.92 NR1H2 (0.58) NR1H2RXRANR1H3NR1I2
SCHEMBL19567525 0.91 RXRA (0.72) NR1H2RXRANR1H3NR1I2
SCHEMBL16407957 0.89 NR1H2 (0.64) NR1H2RXRANR1H3NR1I2
SCHEMBL780565 0.86 NR1H2 (0.66) NR1H2RXRANR1H3NR1I2
SCHEMBL19579162 0.85 RXRA (0.73) NR1H2RXRANR1H3NR1I2
SCHEMBL16407944 0.84 NR1H2 (0.58) NR1H2RXRANR1H3NR1I2
SCHEMBL16407951 0.84 NR1H2 (0.58) NR1H2RXRANR1H3NR1I2
SCHEMBL779292 0.84 NR1H2 (0.72) NR1H2RXRANR1H3NR1I2

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 9 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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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 NR1H2 4537/4885RXRA 2268/4885NR1H3 4400/4885
US-11648220-B2 Methods for the treatment of myeloid derived suppressor cells related disorders NR1H3, NR1H2, MCL1 NR1H2 2/4885RXRA 20/4885NR1H3 1/4885
US-20230338314-A1 METHODS FOR THE TREATMENT OF MYELOID DERIVED SUPPRESSOR CELLS RELATED DISORDERS NR1H3, NR1H2, MCL1 NR1H2 2/4885RXRA 20/4885NR1H3 1/4885
US-20150073053-A1 TREATMENT OF DRUG RESISTANT CANCER ABCC1, TSG101, NTPCR NR1H2 3830/4885RXRA 2119/4885NR1H3 3331/4885
US-20160331726-A1 TREATMENT AND DIAGNOSIS OF MELANOMA EYA3, BRAF, CD99 NR1H2 4537/4885RXRA 2268/4885NR1H3 4400/4885
US-20180153833-A1 TREATMENT AND DIAGNOSIS OF MELANOMA EYA3, BRAF, CD99 NR1H2 4537/4885RXRA 2268/4885NR1H3 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.