SCHEMBL10358052

SCHEMBL10358052

C=CC[N+](CC=C)[N+](=O)[O-]

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CPA1 P15085 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
SCHEMBL168340 0.75
SCHEMBL3305768 0.67
SCHEMBL902747 0.66 TSHR (0.33)
SCHEMBL252512 0.65
SCHEMBL2489867 0.63 MEN1 (0.38) CPA1
SCHEMBL27533732 0.63
SCHEMBL6400625 0.63
Allyl Alcohol SCHEMBL27539000 0.61
SCHEMBL17206269 0.61
Allylamine SCHEMBL27966824 0.61

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-0207389-B1 PLANT GROWTH REGULATING AGENT BASF Aktiengesellschaft (DE) 1990-12-19 EP claimed
US-4430341-A INSECTICIDES, MITICIDES UNION CARBIDE CORPORATION (US) 1984-02-07 US claimed