SCHEMBL16455488

SCHEMBL16455488

CS(=O)(=O)c1cccc(-c2nnc(-c3cc(C(F)(F)F)nn3CC(=O)O)s2)c1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRA P19793 6/20 0.51
NR1H2 P55055 6/20 0.51
NR1H3 Q13133 6/20 0.51
PTGS2 P35354 2/20 0.46
PIK3CA P42336 1/20 0.45
HSP90AA1 P07900 1/20 0.43
PTGDR2 Q9Y5Y4 4/20 0.41
KCNH2 Q12809 1/20 0.39
SYK P43405 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
SCHEMBL16455493 0.89 RXRA (0.49) RXRANR1H2NR1H3PTGS2PIK3CA
SCHEMBL16455482 0.88 HSP90AA1 (0.49) RXRANR1H2NR1H3PTGS2PIK3CA
SCHEMBL3472596 0.87 RXRA (0.66) RXRANR1H2NR1H3PTGS2PIK3CA
SCHEMBL15229773 0.85 NR1H2 (0.58) RXRANR1H2NR1H3PTGS2
SCHEMBL16455494 0.85 NR1H2 (0.46) RXRANR1H2NR1H3PTGS2PIK3CA
SCHEMBL16455257 0.85 RXRA (0.46) RXRANR1H2NR1H3PTGS2PIK3CA
SCHEMBL16455400 0.85 RXRA (0.46) RXRANR1H2NR1H3PTGS2PIK3CA
SCHEMBL16455495 0.84 NR1H2 (0.44) RXRANR1H2NR1H3PTGS2PIK3CA
SCHEMBL16770160 0.83 CARM1 (0.47) RXRANR1H2NR1H3PTGS2HSP90AA1
SCHEMBL16455475 0.83 NR1H2 (0.43) RXRANR1H2NR1H3PTGS2PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210101895-A1 LIVER X RECEPTOR (LXR) MODULATORS FOR THE TREATMENT OF DERMAL DISEASES, DISORDERS AND CONDITIONS RALEXAR THERAPEUTICS, INC. 2021-04-08 US disclosed
EP-3441390-A1 LIVER X RECEPTOR (LXR) MODULATORS FOR THE TREATMENT OF DERMAL DISEASES, DISORDERS AND CONDITIONS Ralexar Therapeutics, Inc. (US) 2019-02-13 EP disclosed
US-20170334897-A1 Liver X Receptor (LXR) Modulators For The Treatment Of Dermal Diseases, Disorders And Conditions ALEXAR THERAPEUTICS, INC. 2017-11-23 US disclosed
US-9637481-B2 Liver X receptor (LXR) modulators for the treatment of dermal diseases, disorders and conditions RALEXAR THERAPEUTICS, INC. (US) 2017-05-02 US disclosed
US-20150152094-A1 LIVER X RECEPTOR (LXR) MODULATORS FOR THE TREATMENT OF DERMAL DISEASES, DISORDERS AND CONDITIONS RALEXAR THERAPEUTICS, INC. 2015-06-04 US disclosed
US-8987318-B2 Liver X receptor (LXR) modulators for the treatment of dermal diseases, disorders and conditions ALEXAR THERAPEUTICS, INC. (US) 2015-03-24 US disclosed
US-20150045399-A1 Liver X Receptor (LXR) Modulators For The Treatment Of Dermal Diseases, Disorders And Conditions ALEXAR THERAPEUTICS, INC. (US) 2015-02-12 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 (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-20150045399-A1 Liver X Receptor (LXR) Modulators For The Treatment Of Dermal Diseases, Disorders And Conditions NR1H2, NR1H3, RXRA RXRA 3/4885NR1H2 1/4885NR1H3 2/4885
US-20170334897-A1 Liver X Receptor (LXR) Modulators For The Treatment Of Dermal Diseases, Disorders And Conditions NR1H2, NR1H3, RXRA RXRA 3/4885NR1H2 1/4885NR1H3 2/4885
US-20210101895-A1 LIVER X RECEPTOR (LXR) MODULATORS FOR THE TREATMENT OF DERMAL DISEASES, DISORDERS AND CONDITIONS NR1H2, NR1H3, RXRG RXRA 4/4885NR1H2 1/4885NR1H3 2/4885
US-20150152094-A1 LIVER X RECEPTOR (LXR) MODULATORS FOR THE TREATMENT OF DERMAL DISEASES, DISORDERS AND CONDITIONS NR1H2, NR1H3, RXRA RXRA 3/4885NR1H2 1/4885NR1H3 2/4885

“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.