SCHEMBL27484249

SCHEMBL27484249

CNCC1(OC(C)=O)CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.33
SLC6A3 Q01959 6/20 0.32
SLC6A2 P23975 3/20 0.32
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL27485317 0.83 TSHR (0.39) LMNATP53ALDH1A1
SCHEMBL27548741 0.81 SLC6A2 (0.33) SLC6A4SLC6A3SLC6A2LMNA
SCHEMBL13649534 0.78 ALDH1A1 (0.32) LMNAALDH1A1
SCHEMBL14883391 0.78 ALDH1A1 (0.32) LMNAALDH1A1
SCHEMBL440062 0.78 ALDH1A1 (0.32) LMNAALDH1A1
SCHEMBL27472632 0.78 KMT2A (0.35)
SCHEMBL27484623 0.78 MAPT (0.38) LMNAALDH1A1SMN1; SMN2
SCHEMBL27483913 0.78 MEN1 (0.32)
SCHEMBL5046422 0.76 P2RX7 (0.30)
SCHEMBL27470787 0.76 ALDH1A1 (0.31) ALDH1A1

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
CN-1626069-A Branched chain amino acid-dependent aminotransferase inhibitors and their use in the treatment of diabetic retinopathy WARNER LAMBERT CO (US) 2005-06-15 CN claimed
CN-1344245-A Inhibitors of branched chain amino acid dependent aminotransferases and their use in the treatment of diabetic retinopathy WARNER LAMBER CO (US) 2002-04-10 CN claimed
CN-1626069-A Branched chain amino acid-dependent aminotransferase inhibitors and their use in the treatment of diabetic retinopathy WARNER LAMBERT CO (US) 2005-06-15 CN disclosed
CN-1170811-C Inhibitors of branched chain amino acid dependent aminotransferases and their use in the treatment of diabetic retinopathy ��ʲ 2004-10-13 CN disclosed
CN-1344245-A Inhibitors of branched chain amino acid dependent aminotransferases and their use in the treatment of diabetic retinopathy WARNER LAMBER CO (US) 2002-04-10 CN disclosed