SCHEMBL11726344

SCHEMBL11726344

CCN(CC)CCN=C=O

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL7670917 0.84
SCHEMBL26488859 0.82 NPSR1 (0.38) NPSR1
SCHEMBL13463212 0.79 CA12 (0.34) NPSR1
SCHEMBL6668505 0.75 NPSR1 (0.31) NPSR1
SCHEMBL1269248 0.75 NAAA (0.44) NPSR1
SCHEMBL1196883 0.74
SCHEMBL6365388 0.74 CA12 (0.32)
SCHEMBL7501948 0.73 CYP1A2 (0.39)
Hydrochloric Acid SCHEMBL6017813 0.71 CYP1A2 (0.52)
Hydrochloric Acid SCHEMBL7614612 0.71 CYP1A2 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4045483-A BACTERICIDES, FUNGICIDES STERLING DRUG INC. (US) 1977-08-30 US disclosed
US-4009163-A BACTERICIDES, FUNGICIDES STERLING DRUG INC. (US) 1977-02-22 US disclosed
US-3988370-A BACTERICIDES, FUNGICIDES STERLING DRUG INC. (US) 1976-10-26 US disclosed