SCHEMBL6982654

SCHEMBL6982654

CC(C)C[C@@H](C(=O)NN(CC(C)C)C(=O)[C@@H](C)N)C(CCCc1ccccc1)C(=O)NO

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 5/20 0.52
MMP13 P45452 2/20 0.52
MMP8 P22894 3/20 0.45
ADAM17 P78536 3/20 0.43
FCER2 P06734 4/20 0.43
TSHR P16473 1/20 0.42
MMP2 P08253 5/20 0.41
MMP9 P14780 2/20 0.41
ANPEP P15144 1/20 0.40
MMP3 P08254 5/20 0.39
MMP7 P09237 3/20 0.39
MMP12 P39900 1/20 0.39
MMP14 P50281 1/20 0.39

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
SCHEMBL6980442 0.87 MMP1 (0.42) MMP1MMP13MMP8ADAM17FCER2
SCHEMBL6984793 0.81 MMP1 (0.39) MMP1MMP13MMP8ADAM17FCER2
SCHEMBL6981622 0.80 ADAM17 (0.68) MMP1MMP13MMP8ADAM17FCER2
SCHEMBL6985193 0.80 MMP1 (0.50) MMP1MMP13MMP8ADAM17FCER2
Hydrochloric Acid SCHEMBL6986337 0.80 MMP1 (0.38) MMP1MMP13MMP8ADAM17FCER2
SCHEMBL7855580 0.79 MMP1 (0.62) MMP1MMP13MMP8FCER2TSHR
Hydrochloric Acid SCHEMBL6986451 0.79 ADAM17 (0.67) MMP1MMP13MMP8ADAM17FCER2
SCHEMBL6983149 0.79 MMP2 (0.37) MMP1MMP13MMP8TSHRMMP2
SCHEMBL6982089 0.79 MMP1 (0.47) MMP1MMP13MMP8ADAM17FCER2
SCHEMBL6941577 0.78 MMP1 (0.50) MMP1MMP13MMP8ADAM17FCER2

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