SCHEMBL22823975

SCHEMBL22823975

CCC(=O)c1cc(Cl)c(F)cc1O[C@@H](CF)COCc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.37
PPARG P37231 3/20 0.37
MAPK14 Q16539 1/20 0.36
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
PIM1 P11309 1/20 0.35
ABCB1 P08183 1/20 0.34
SCN9A Q15858 1/20 0.34
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
CTSB P07858 1/20 0.34
UGCG Q16739 1/20 0.33
GRM5 P41594 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL29369333 1.00 PPARA (0.37) PPARAPPARGMAPK14NPC1HPGD
SCHEMBL28688897 1.00 PPARA (0.37) PPARAPPARGMAPK14NPC1HPGD
SCHEMBL29368299 0.88 SMN1; SMN2 (0.35) NPC1HPGDRAB9ASMN1; SMN2ABCB1
SCHEMBL22823743 0.88 SMN1; SMN2 (0.35) NPC1HPGDRAB9ASMN1; SMN2ABCB1
SCHEMBL28672381 0.88 SMN1; SMN2 (0.35) NPC1HPGDRAB9ASMN1; SMN2ABCB1
SCHEMBL22823736 0.81 PTGER1 (0.40) NPC1HPGDRAB9ASMN1; SMN2KDM4E
SCHEMBL29368013 0.81 PTGER1 (0.40) NPC1HPGDRAB9ASMN1; SMN2KDM4E
SCHEMBL28673201 0.81 PTGER1 (0.40) NPC1HPGDRAB9ASMN1; SMN2KDM4E
SCHEMBL22823978 0.81 TSHR (0.33) PPARAPPARGSCN9A
SCHEMBL29602246 0.81 TSHR (0.33) PPARAPPARGSCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220388938-A1 COMPOUNDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD PHARMA A/S (DK) 2022-12-08 US disclosed
CN-114008012-A Compounds for the treatment of neuromuscular disorders NMD制药股份公司 2022-02-01 CN disclosed
WO-2020254559-A1 COMPOUNDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD PHARMA A/S (DK) 2020-12-24 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 (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-20220388938-A1 COMPOUNDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS RYR1, CACNB1, SMN1; SMN2 PPARA 3710/4885PPARG 3395/4885MAPK14 3832/4885

“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.