SCHEMBL8876261

SCHEMBL8876261

CCOC(=O)C1CC(C)C(C)N1C(=O)Cc1c(C)cccc1C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.42
MEN1 O00255 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
GAA P10253 1/20 0.39
NR1D1 P20393 2/20 0.38
ALDH1A1 P00352 8/20 0.37
MAPT P10636 1/20 0.36
KDM4E B2RXH2 3/20 0.36
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
LMNA P02545 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HSD17B10 Q99714 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
SCHEMBL8879041 0.88 KMT2A (0.53) KMT2AMEN1SMN1; SMN2GAANR1D1
SCHEMBL8877801 0.88 KMT2A (0.36) KMT2AMEN1SMN1; SMN2GAAALDH1A1
SCHEMBL8878145 0.84 KMT2A (0.41) KMT2AMEN1SMN1; SMN2GAANR1D1
SCHEMBL8877500 0.82 ALDH1A1 (0.47) KMT2AMEN1SMN1; SMN2GAAALDH1A1
SCHEMBL8875077 0.81 KMT2A (0.42) KMT2AMEN1SMN1; SMN2GAANR1D1
SCHEMBL8316864 0.81 ALDH1A1 (0.38) KMT2AMEN1SMN1; SMN2GAAALDH1A1
SCHEMBL8876270 0.81 KMT2A (0.40) KMT2AMEN1SMN1; SMN2GAAALDH1A1
SCHEMBL8877115 0.81 KMT2A (0.39) KMT2AMEN1SMN1; SMN2GAAALDH1A1
SCHEMBL8878394 0.80 SMN1; SMN2 (0.39) KMT2AMEN1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL8876386 0.78 CTSS (0.40) KMT2AMEN1SMN1; SMN2GAANR1D1

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-5693663-A PESTICIDES; HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-02 US disclosed
US-5585384-A 1-OXY-FUNCTIONAL GROUP-2-ALKYLARYL-3-OXO-PYRROLIZINES; INSECTICIDES; NEMATOCIDES; HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-12-17 US disclosed
US-5288874-A Insecticides, miticides BAYER AKTIENGESELLSCHAFT (DE) 1994-02-22 US disclosed