SCHEMBL6987230

SCHEMBL6987230

CCCC(Cc1ccccc1)(C(=O)NN)C(=O)[C@@H]([C@H](CCCC1CCCCC1)C(=O)NOC1CCCCO1)N1CN(C)C=N1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 3/20 0.31
MMP2 P08253 1/20 0.31
REN P00797 2/20 0.31
BCHE P06276 1/20 0.31
PPARG P37231 2/20 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
SCHEMBL6979963 0.95 PPARG (0.33) BMP1MMP2BCHEPPARG
SCHEMBL6988228 0.94 TGFBR1 (0.30)
SCHEMBL6981509 0.87 PPARG (0.32) BMP1MMP2RENBCHEPPARG
SCHEMBL7142417 0.84 MMP2 (0.36) BMP1MMP2BCHEPPARG
SCHEMBL6982036 0.81 BMP1 (0.32) BMP1MMP2BCHEPPARG
SCHEMBL6988804 0.79 PPARG (0.32) BMP1MMP2BCHEPPARG
SCHEMBL6980503 0.79 TGFBR1 (0.35)
SCHEMBL6983469 0.76 PPARG (0.33) BMP1MMP2BCHEPPARG
SCHEMBL6982855 0.74 TGFBR1 (0.31)
SCHEMBL6982838 0.72 MMP2 (0.34) MMP2

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
EP-1089964-B1 HYDRAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2003-10-29 EP disclosed
US-6239151-B1 TREATMENT OF INFLAMMATORY AND AUTOIMMUNE DISEASES, OSTEOARTHRITIS, RESPIRATORY DISEASES, TUMORS, CACHEXIA, CARDIOVASCULAR DISEASES, FEVER, HAEMORRHAGE AND SEPSIS, HYDRAZINE DERIVATIVES, HOFFMANN-LA ROCHE INC. 2001-05-29 US disclosed
EP-1089964-A1 HYDRAZINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2001-04-11 EP disclosed
WO-2000000465-A1 HYDRAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2000-01-06 WO disclosed