SCHEMBL7805463

SCHEMBL7805463

CC(C)C[C@@H](C(=O)NN)[C@H](C(=O)NOC1CCCCO1)C(CCc1ccccc1)(CC(C)C)C(=O)CC(=O)c1ncc[nH]1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
TSHR P16473 1/20 0.30
KMT2A Q03164 1/20 0.30
MMP3 P08254 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
SCHEMBL7812670 0.85 GPR88 (0.32) MEN1TSHRKMT2AMMP3
SCHEMBL6982555 0.83 ECE1 (0.33)
SCHEMBL6981382 0.83 REN (0.32) MMP3
SCHEMBL7805709 0.80 GPR88 (0.34) MMP3
SCHEMBL7815484 0.78 MMP8 (0.31)
SCHEMBL6983030 0.78 MMP1 (0.32) MMP3
SCHEMBL6982283 0.77 REN (0.36) MMP3
SCHEMBL7805787 0.75 TDP1 (0.32) MEN1KMT2A
SCHEMBL6986852 0.75 EPHX2 (0.32) MEN1TSHRKMT2AMMP3
SCHEMBL6983113 0.74 CYP1A2 (0.36) MEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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