SCHEMBL4934402

SCHEMBL4934402

O=C(O)C(F)Cc1cc(Br)c(OCc2cc(Cl)cc(NC3CCC3)c2)c(Br)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRA P10827 8/20 0.38
THRB P10828 8/20 0.38
DHODH Q02127 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ENPP2 Q13822 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 1/20 0.33
FFAR1 O14842 1/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
ESR1 P03372 1/20 0.32
NR3C1 P04150 1/20 0.32
PGR P06401 1/20 0.32
NR3C2 P08235 1/20 0.32
AR P10275 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL5718054 0.94 MEN1 (0.38) THRATHRBDHODHMEN1KMT2A
SCHEMBL4929570 0.91 FFAR1 (0.35) MEN1KMT2AENPP2NPC1RAB9A
SCHEMBL4933385 0.89 MEN1 (0.39) THRATHRBDHODHMEN1KMT2A
SCHEMBL4932240 0.87 THRA (0.42) THRATHRBDHODH
SCHEMBL5718058 0.86 MEN1 (0.36) THRATHRBMEN1KMT2AENPP2
SCHEMBL5718015 0.86 MEN1 (0.36) THRATHRBMEN1KMT2AFFAR1
SCHEMBL5718319 0.84 THRB (0.51) THRATHRBDHODHENPP2ESR1
SCHEMBL4932962 0.84 THRA (0.38) THRATHRBDHODHFFAR1ESR1
SCHEMBL4922880 0.83 THRB (0.40) THRATHRBDHODHFFAR1ESR1
SCHEMBL4931798 0.83 THRB (0.41) THRATHRBDHODHFFAR1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080221210-A1 Thyroid Receptor Agonists KARO BIO AB (SE) 2008-09-11 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 (1 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-20080221210-A1 Thyroid Receptor Agonists TSHR, TRHR, THRA THRA 3/4885THRB 4/4885DHODH 4020/4885

“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.