SCHEMBL5481771

SCHEMBL5481771

CC(C)CCCCCc1nc(C(=O)O)c2nnn(C)c(=O)n12

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
MEN1 O00255 1/20 0.32
PABPC1 P11940 1/20 0.32
KMT2A Q03164 1/20 0.32
CNOT7 Q9UIV1 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
SCHEMBL5477677 0.95 MEN1 (0.33) MAOAMAOBMEN1PABPC1KMT2A
SCHEMBL5484884 0.86 AGTR1 (0.36) MEN1PABPC1KMT2A
SCHEMBL5472502 0.81 MEN1 (0.37) MEN1PABPC1KMT2A
SCHEMBL5478609 0.78 MEN1 (0.38) MEN1PABPC1KMT2A
SCHEMBL5484430 0.70 MEN1 (0.41) MEN1PABPC1KMT2A
SCHEMBL13524686 0.65 MEN1 (0.46) MEN1PABPC1KMT2A
SCHEMBL14989254 0.59 KDM4C (0.39)
SCHEMBL14989097 0.59 KDM4C (0.39)
SCHEMBL14989286 0.59 KDM4C (0.39)
SCHEMBL14989148 0.59 KDM4C (0.39)

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
EP-1798234-A1 PHARMACEUTICAL COMPOSITION COMPRISING TEMOZOLOMIDE ESTER Tianjin Tasly Group Co., Ltd. (CN) 2007-06-20 EP claimed
EP-1798234-B1 PHARMACEUTICAL COMPOSITION COMPRISING TEMOZOLOMIDE ESTER TIANJIN TASLY GROUP CO LTD (CN) 2012-06-13 EP disclosed
EP-1798234-A1 PHARMACEUTICAL COMPOSITION COMPRISING TEMOZOLOMIDE ESTER Tianjin Tasly Group Co., Ltd. (CN) 2007-06-20 EP disclosed