SCHEMBL21057136

SCHEMBL21057136

CCC(Oc1ccc(Br)cc1I)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
PPARA Q07869 5/20 0.45
LDHA P00338 1/20 0.39
XDH P47989 1/20 0.39
PPARG P37231 3/20 0.39
HTT P42858 1/20 0.39
PTGDR2 Q9Y5Y4 6/20 0.38
MEN1 O00255 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
MMP1 P03956 1/20 0.38
LMNA P02545 1/20 0.38
ATM Q13315 1/20 0.38
HPGD P15428 1/20 0.36

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
SCHEMBL21057133 1.00 SMN1; SMN2 (0.47) SMN1; SMN2PPARALDHAXDHPPARG
SCHEMBL27971306 0.85 SMN1; SMN2 (0.51) SMN1; SMN2PPARAPPARGHTTPTGDR2
SCHEMBL21057243 0.84 PPARA (0.39) PPARALDHAPPARGPTGDR2MEN1
SCHEMBL21057242 0.84 PPARA (0.39) PPARALDHAPPARGPTGDR2MEN1
SCHEMBL4812741 0.84 SMN1; SMN2 (0.48) SMN1; SMN2PPARAPPARGHTTPTGDR2
SCHEMBL4816920 0.84 PPARA (0.59) SMN1; SMN2PPARAPPARGHTTPTGDR2
SCHEMBL4817990 0.82 PPARA (0.49) SMN1; SMN2PPARAPPARGPTGDR2
SCHEMBL21057144 0.82 PPARA (0.50) SMN1; SMN2PPARAPPARGMEN1TSHR
SCHEMBL21057134 0.82 PPARA (0.49) SMN1; SMN2PPARAPPARGPTGDR2
SCHEMBL4819977 0.82 PPARA (0.50) SMN1; SMN2PPARAPPARGMEN1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3723745-A1 PHENOXY ACIDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD Pharma A/S (DK) 2020-10-21 EP claimed
CN-111587109-A Phenoxy acids for the treatment of neuromuscular disorders NMD制药股份公司 2020-08-25 CN claimed
WO-2019115777-A1 PHENOXY ACIDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD PHARMA A/S (DK) 2019-06-20 WO claimed
US-20190183834-A1 Compounds For The Treatment Of Neuromuscular Disorders NMD PHARMA A/S (DK) 2019-06-20 US claimed
EP-3723745-B1 PHENOXY ACIDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD PHARMA AS (DK) 2024-06-19 EP disclosed
US-11730714-B2 Compounds for the treatment of neuromuscular disorders NMD PHARMA A/S (DK) 2023-08-22 US disclosed
EP-3723745-A1 PHENOXY ACIDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD Pharma A/S (DK) 2020-10-21 EP disclosed
CN-111587109-A Phenoxy acids for the treatment of neuromuscular disorders NMD制药股份公司 2020-08-25 CN disclosed
WO-2019115777-A1 PHENOXY ACIDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD PHARMA A/S (DK) 2019-06-20 WO disclosed
US-20190183834-A1 Compounds For The Treatment Of Neuromuscular Disorders NMD PHARMA A/S (DK) 2019-06-20 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 (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-11730714-B2 Compounds for the treatment of neuromuscular disorders RYR1, CACNB1, RYR2 SMN1; SMN2 13/4885PPARA 3247/4885LDHA 2645/4885
US-20190183834-A1 Compounds For The Treatment Of Neuromuscular Disorders RYR1, CACNB1, RYR2 SMN1; SMN2 13/4885PPARA 3247/4885LDHA 2645/4885

“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.