SCHEMBL1458048

SCHEMBL1458048

CCOc1c(Br)cc(C(=O)O)cc1Br

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.64
TPMT P51580 1/20 0.56
TSHR P16473 2/20 0.51
HSD17B10 Q99714 1/20 0.51
NCOA1 Q15788 1/20 0.51
NCOA3 Q9Y6Q9 1/20 0.51
THRA P10827 4/20 0.50
TTR P02766 1/20 0.50
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.48
ALOX15 P16050 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL14907068 0.87 KMT2A (0.59) THRBTPMTTSHRNCOA1NCOA3
SCHEMBL1457751 0.84 THRB (0.48) THRBTPMTTSHRHSD17B10NCOA1
SCHEMBL9623646 0.84 TPMT (0.55) THRBTPMTTHRATTRKMT2A
SCHEMBL14907059 0.83 NCOA1 (0.76) TPMTTSHRHSD17B10NCOA1NCOA3
SCHEMBL1457769 0.81 PLAU (0.64) TPMTHSD17B10TTRKMT2AMEN1
SCHEMBL1459236 0.81 MEN1 (0.65) HSD17B10KMT2AMEN1LMNAPOLB
SCHEMBL1457994 0.80 MEN1 (0.57) THRBKMT2AMEN1LMNAPOLB
SCHEMBL504156 0.78 TSHR (0.70) TSHRKMT2AMEN1LMNAPOLB
SCHEMBL15524451 0.78 TPMT (0.59) THRBTPMTTSHRHSD17B10LMNA
SCHEMBL3546802 0.78 TPMT (0.79) THRBTPMTTSHRHSD17B10NCOA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9447028-B2 Therapeutic aryl-amido-aryl compounds and their use KING'S COLLEGE LONDON (GB) 2016-09-20 US disclosed
US-20160039747-A1 Therapeutic Aryl-Amido-Aryl Compounds and Their Use KING'S COLLEGE LONDON (GB) 2016-02-11 US disclosed
EP-2473479-A1 THERAPEUTIC ARYL-AM I DO-ARYL COMPOUNDS AND THEIR USE King's College London (GB) 2012-07-11 EP disclosed
US-20120149737-A1 Therapeutic Aryl-Amido-Aryl Compounds and Their Use KING'S COLLEGE LONDON (GB) 2012-06-14 US disclosed
WO-2011027106-A1 THERAPEUTIC ARYL-AM I DO-ARYL COMPOUNDS AND THEIR USE KING'S COLLEGE LONDON (GB) 2011-03-10 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-20120149737-A1 Therapeutic Aryl-Amido-Aryl Compounds and Their Use RARA, RARB, RARG THRB 642/4885TPMT 2218/4885TSHR 704/4885
US-20160039747-A1 Therapeutic Aryl-Amido-Aryl Compounds and Their Use RARA, RARB, RARG THRB 642/4885TPMT 2218/4885TSHR 704/4885

“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.