SCHEMBL25928849

SCHEMBL25928849

CC(C)(C)C(=O)CC(NC(=O)C(C)(C)C)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.36
MME P08473 1/20 0.36
ACE2 Q9BYF1 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
ALOX15 P16050 1/20 0.35
NFKB1 P19838 1/20 0.35
PTGS2 P35354 1/20 0.35
THPO P40225 1/20 0.35
RECQL P46063 1/20 0.35
BLM P54132 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ECE1 P42892 2/20 0.35
FOLH1 Q04609 2/20 0.34
NAALAD2 Q9Y3Q0 2/20 0.34
ALDH1A1 P00352 2/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
GRN P28799 1/20 0.34

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
SCHEMBL15605968 0.86 CA2 (0.47) MMEMAPTCA2CA4
SCHEMBL2551598 0.86 CA2 (0.47) MMEMAPTCA2CA4
SCHEMBL2551596 0.86 CA2 (0.47) MMEMAPTCA2CA4
SCHEMBL8580669 0.85 SMN1; SMN2 (0.32) KDM4ERECQLSMN1; SMN2ALDH1A1CYP1A2
SCHEMBL16675994 0.84 MAPT (0.53) KDM4EMAPTTHRBALOX15NFKB1
SCHEMBL5191274 0.82 ECE1 (0.50) ACEMMEACE2ECE1ALDH1A1
SCHEMBL8580667 0.82 CNR2 (0.32) NPSR1CNR2
SCHEMBL25928846 0.81 NPSR1 (0.37) MMESMN1; SMN2CA2NPSR1CNR2
SCHEMBL21515914 0.79 ALDH1A1 (0.41) ACEMMEACE2ECE1FOLH1
SCHEMBL20912463 0.79 TGFBR1 (0.52) ACEMMEACE2KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11814391-B2 Macrocyclic compounds for the treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2023-11-14 US disclosed
US-20230357199-A1 ARYL, HETEROARYL, AND HETEROCYCLIC PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2023-11-09 US disclosed
US-11718626-B2 Macrocyclic compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2023-08-08 US disclosed
US-11708351-B2 Aryl, heteroaryl, and heterocyclic pharmaceutical compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2023-07-25 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 (4 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-11718626-B2 Macrocyclic compounds for treatment of medical disorders CFD, TFPI, CFH ACE 146/4885MME 213/4885ACE2 452/4885
US-11708351-B2 Aryl, heteroaryl, and heterocyclic pharmaceutical compounds for treatment of medical disorders CFD, TFPI, CFH ACE 167/4885MME 236/4885ACE2 413/4885
US-20230357199-A1 ARYL, HETEROARYL, AND HETEROCYCLIC PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH ACE 167/4885MME 236/4885ACE2 413/4885
US-11814391-B2 Macrocyclic compounds for the treatment of medical disorders CFD, TFPI, CFH ACE 81/4885MME 123/4885ACE2 171/4885

“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.