SCHEMBL18937280

SCHEMBL18937280

CCNCC(C)CCC(C)NCC

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.32
KDM4E B2RXH2 1/20 0.31
TP53 P04637 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
SCHEMBL11508620 0.85 TP53 (0.41) KDM4ETP53
SCHEMBL22505760 0.78 TP53 (0.35) KDM4ETP53
SCHEMBL20016953 0.78 TP53 (0.35) KDM4ETP53
SCHEMBL25878482 0.78 SIGMAR1 (0.35) SIGMAR1
SCHEMBL22908524 0.78
SCHEMBL332013 0.78
SCHEMBL21029496 0.76 TSHR (0.46) KDM4ETP53
SCHEMBL330817 0.75 CYP2C19 (0.41) SIGMAR1KDM4ETP53
SCHEMBL13679247 0.75
SCHEMBL7649165 0.75

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-2751564-B1 METHODS OF TRIGGERING ACTIVATION OF ENCAPSULATED SIGNAL-GENERATING SUBSTANCES JUPITER DIAGNOSTICS HOLDING COMPANY LTD (GB) 2017-06-07 EP disclosed