SCHEMBL22823911

SCHEMBL22823911

C=Cc1ccc(O[C@@H](C)C(=O)OC)c(C(F)(F)CC)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.38
TAS1R1 Q7RTX1 2/20 0.38
F9 P00740 1/20 0.35
PLAU P00749 1/20 0.35
NOS3 P29474 3/20 0.34
NOS1 P29475 3/20 0.34
NOS2 P35228 3/20 0.34
APP P05067 2/20 0.34
TRPA1 O75762 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
POLB P06746 1/20 0.33
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
MCL1 Q07820 1/20 0.32
P2RX3 P56373 1/20 0.31
PSMB5 P28074 1/20 0.31

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
SCHEMBL29601840 1.00 TAS1R3 (0.38) TAS1R3TAS1R1F9PLAUNOS3
SCHEMBL28671836 0.88 PPARG (0.39) PPARGPPARDPPARARXRARXRB
SCHEMBL22823910 0.88 PPARG (0.39) PPARGPPARDPPARARXRARXRB
SCHEMBL29368192 0.88 PPARG (0.39) PPARGPPARDPPARARXRARXRB
SCHEMBL24775125 0.83 SMN1; SMN2 (0.37) F9PLAUSMN1; SMN2POLBRXRA
SCHEMBL29601813 0.83 SMN1; SMN2 (0.37) F9PLAUSMN1; SMN2POLBRXRA
SCHEMBL22805702 0.82 LMNA (0.44) F9PLAUSMN1; SMN2POLBKDM4E
SCHEMBL22805703 0.82 LMNA (0.44) F9PLAUSMN1; SMN2POLBKDM4E
SCHEMBL24775126 0.81 F9 (0.34) F9PLAUSMN1; SMN2POLB
SCHEMBL29602001 0.81 F9 (0.34) F9PLAUSMN1; SMN2POLB

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-12415771-B2 Compounds for the treatment of neuromuscular disorders NMD PHARMA A/S (DK) 2025-09-16 US disclosed
EP-3986852-B1 COMPOUNDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD PHARMA AS (DK) 2024-10-16 EP disclosed
US-20220388938-A1 COMPOUNDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD PHARMA A/S (DK) 2022-12-08 US disclosed
US-20220388938-A1 COMPOUNDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS NMD PHARMA A/S (DK) 2022-12-08 US 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 (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-20220388938-A1 COMPOUNDS FOR THE TREATMENT OF NEUROMUSCULAR DISORDERS RYR1, CACNB1, SMN1; SMN2 TAS1R3 2597/4885TAS1R1 2133/4885F9 4558/4885
US-12415771-B2 Compounds for the treatment of neuromuscular disorders RYR1, CACNB1, SMN1; SMN2 TAS1R3 2597/4885TAS1R1 2133/4885F9 4558/4885

“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.