SCHEMBL13636616

SCHEMBL13636616

CCC(N)CCC(C)C(C)CCC1CCC1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.36
METAP2 P50579 1/20 0.33
CYP1A2 P05177 1/20 0.32

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
SCHEMBL27437254 0.81 CYP1A2 (0.50) METAP1METAP2CYP1A2
SCHEMBL11982905 0.78
SCHEMBL1678740 0.78
SCHEMBL23050301 0.76 CYP1A2 (0.41) METAP1METAP2CYP1A2
SCHEMBL20003525 0.73 METAP1 (0.48) METAP1METAP2CYP1A2
SCHEMBL12262722 0.73 METAP1 (0.48) METAP1METAP2CYP1A2
SCHEMBL23312962 0.73 METAP1 (0.33) METAP1METAP2CYP1A2
SCHEMBL24466581 0.72 METAP1 (0.37) METAP1METAP2
SCHEMBL22229853 0.71 METAP1 (0.52) METAP1METAP2CYP1A2
SCHEMBL2062321 0.71 METAP1 (0.52) METAP1METAP2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242385-B1 CYTOKINE, ESPECIALLY TNF-ALPHA, INHIBITORS PHARMACOPEIA INC (US) 2009-11-25 EP disclosed