SCHEMBL6986895

SCHEMBL6986895

CCCC(C[C@@H](c1ccc(C)cc1)[C@H](CCCC1CCCCC1)C(=O)NOC1CCCCO1)(C(=O)Cn1ccnc1)C(=O)NN

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 2/20 0.31
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TGFBR1 P36897 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
SCHEMBL6989595 0.85 BMP1 (0.35) BMP1ALDH1A1SMN1; SMN2
SCHEMBL6986599 0.72 TGFBR1 (0.31) TGFBR1
SCHEMBL7805790 0.71
SCHEMBL6982036 0.71 BMP1 (0.32) BMP1TGFBR1
SCHEMBL6983469 0.71 PPARG (0.33) BMP1TGFBR1
SCHEMBL6981509 0.70 PPARG (0.32) BMP1TGFBR1
SCHEMBL6983333 0.70 TGFBR1 (0.33) TGFBR1
SCHEMBL6987230 0.68 BMP1 (0.31) BMP1
SCHEMBL6979963 0.68 PPARG (0.33) BMP1
SCHEMBL6981390 0.68 BMP1 (0.37) BMP1

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