SCHEMBL9835828

SCHEMBL9835828

CCN(CC)N(CC)CCCCOC1CCC(C(C)(C)C)CC1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
TSHR P16473 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL26764011 0.75 MEN1 (0.46) HTTMEN1KMT2AL3MBTL1TSHR
SCHEMBL9833140 0.75 MEN1 (0.39) HTTMEN1KMT2AL3MBTL1TSHR
SCHEMBL5737986 0.73 MEN1 (0.40) HTTMEN1KMT2AL3MBTL1TSHR
SCHEMBL24856586 0.72 MEN1 (0.37) HTTMEN1KMT2AL3MBTL1TSHR
SCHEMBL9835826 0.72 MEN1 (0.41) HTTMEN1KMT2AL3MBTL1TSHR
SCHEMBL18532901 0.71 MEN1 (0.46) HTTMEN1KMT2AL3MBTL1TSHR
SCHEMBL11913498 0.71 MEN1 (0.46) HTTMEN1KMT2AL3MBTL1TSHR
SCHEMBL13141317 0.70 MEN1 (0.44) HTTMEN1KMT2AL3MBTL1TSHR
SCHEMBL15222418 0.69 MEN1 (0.45) HTTMEN1KMT2AL3MBTL1TSHR
SCHEMBL19835388 0.68 MEN1 (0.39) HTTMEN1KMT2AL3MBTL1TSHR

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-0234255-B1 N-(ALKYLAMINO)-AZOLYLUREAS AND FUNGICIDES CONTAINING THEM BASF Aktiengesellschaft (DE) 1991-03-20 EP disclosed
EP-0234255-A1 N-(Alkylamino)-azolylureas and fungicides containing them BASF Aktiengesellschaft (DE) 1987-09-02 EP disclosed