SCHEMBL12470795

SCHEMBL12470795

CCC(N)(N)N(C(N)(N)CC)C(N)(N)CC

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL3030498 0.74
SCHEMBL10343035 0.74
SCHEMBL10534185 0.74
Ammonia Solution, Strong SCHEMBL4375415 0.72
SCHEMBL6168752 0.72
SCHEMBL3698991 0.69
SCHEMBL25355050 0.67 TSHR (0.38) TSHRTDP1
SCHEMBL419403 0.65
SCHEMBL6663234 0.65 TSHR (0.42) TSHRTDP1
SCHEMBL1507864 0.65

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
WO-2012103808-A1 RELEASE AGENT, PREPARATION AND USE THEREOF HENKEL AG & CO. KGAA (DE) 2012-08-09 WO claimed
WO-2012104346-A1 A RELEASE AGENT, THE PREPARATION AND USE THEREOF HENKEL AG & CO. KGAA (DE) 2012-08-09 WO claimed
WO-2012103808-A1 RELEASE AGENT, PREPARATION AND USE THEREOF HENKEL AG & CO. KGAA (DE) 2012-08-09 WO disclosed
WO-2012104346-A1 A RELEASE AGENT, THE PREPARATION AND USE THEREOF HENKEL AG & CO. KGAA (DE) 2012-08-09 WO disclosed