SCHEMBL8950560

SCHEMBL8950560

CCOC(=O)N1CCCCN1C(=O)Cc1c(C)cc(C)cc1C

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
MAPK1 P28482 1/20 0.43
POLB P06746 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL13527339 0.92 MEN1 (0.40) MEN1KMT2AMAPK1POLBHRH3
SCHEMBL3169396 0.89 MEN1 (0.35) MEN1KMT2AMAPK1POLBHPGD
SCHEMBL14335874 0.87 KMT2A (0.40) MEN1KMT2AMAPK1TP53SMN1; SMN2
SCHEMBL2430037 0.85 KMT2A (0.35) MEN1KMT2APOLBHPGDSMN1; SMN2
SCHEMBL3761042 0.81 LMNA (0.40) MEN1KMT2AMAPK1TP53HPGD
SCHEMBL14335890 0.80 KMT2A (0.37) MEN1KMT2AMAPK1POLBL3MBTL1
SCHEMBL1152756 0.80 ALDH1A1 (0.38) MEN1KMT2AMAPK1POLBHPGD
SCHEMBL1812603 0.80 SMN1; SMN2 (0.42) MEN1KMT2APOLBSMN1; SMN2ALDH1A1
SCHEMBL14405362 0.79 MEN1 (0.36) MEN1KMT2AMAPK1HPGDSMN1; SMN2
SCHEMBL14405324 0.79 KMT2A (0.36) MEN1KMT2AMAPK1POLBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0577629-B1 NOVEL HERBICIDALLY, ACARICIDALLY AND INSECTICIDALLY ACTIVE COMPOUNDS CIBA GEIGY AG (CH) 1996-06-26 EP disclosed
WO-1996011574-A1 HERBICIDAL COMPOSITIONS NOVARTIS AG (CH) 1996-04-25 WO disclosed
US-5506193-A Herbicidally, acaricidally and insecticidally active pyrazolidine compounds CIBA-GEIGY CORPORATION (US) 1996-04-09 US disclosed
US-5494890-A FOR CONTROLLING WEEDS, INSECTS, MITES CIBA-GEIGY CORPORATION (US) 1996-02-27 US disclosed
WO-1992016510-A1 NOVEL HERBICIDALLY, ACARICIDALLY AND INSECTICIDALLY ACTIVE COMPOUNDS CIBA-GEIGY AG (CH) 1992-10-01 WO disclosed