SCHEMBL5274444

SCHEMBL5274444

CCCCc1nnnn1C(=O)n1cnnn1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 2/20 0.40
FAAH O00519 1/20 0.31
ALDH1A1 P00352 1/20 0.31
AGTR2 P50052 1/20 0.31
TRPV1 Q8NER1 1/20 0.30
HTT P42858 1/20 0.30
HMOX1 P09601 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
SCHEMBL5276589 0.96 DAGLA (0.40) DAGLAFAAHTRPV1
SCHEMBL5279769 0.92 DAGLA (0.38) DAGLAFAAHALDH1A1TRPV1HMOX1
SCHEMBL5276277 0.79 DAGLA (0.35) DAGLAFAAHALDH1A1TRPV1
SCHEMBL5275474 0.76 KCNJ1 (0.36) ALDH1A1
SCHEMBL5274003 0.74 TRPV1 (0.53) DAGLAFAAHALDH1A1TRPV1HMOX1
SCHEMBL5282490 0.71 KCNJ1 (0.31) FAAH
Bromide SCHEMBL27698944 0.70 DAGLA (0.46) DAGLAFAAHALDH1A1TRPV1
SCHEMBL5277887 0.68 THRB (0.32)
SCHEMBL5280089 0.67
SCHEMBL5276885 0.66

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-1859783-A1 Brightening and/or colouring agent comprising N, N'-carbonyldiazoles and/or analagogues thereof Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed