SCHEMBL11468600

SCHEMBL11468600

Cc1ccc(N2C(=O)NOC2(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 1/20 0.49
APBA1 Q02410 1/20 0.49
ELANE P08246 2/20 0.45
F2 P00734 1/20 0.45
CTSG P08311 1/20 0.45
CMA1 P23946 1/20 0.45
CTRC Q99895 1/20 0.45
MAPK1 P28482 1/20 0.45
MGLL Q99685 1/20 0.42
MAPT P10636 1/20 0.42
POLB P06746 1/20 0.40
ALDH1A1 P00352 2/20 0.37
PGR P06401 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALOX5 P09917 1/20 0.36
TP53 P04637 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
SCHEMBL11476355 0.84 FAAH (0.41) CACNA1BAPBA1MGLLMAPTPOLB
SCHEMBL11469490 0.83 CACNA1B (0.47) CACNA1BAPBA1ELANEMGLLALDH1A1
SCHEMBL11484163 0.76 DHFR (0.42) MAPTPOLBALDH1A1GAALMNA
SCHEMBL11466908 0.73 MEN1 (0.46) MGLLMAPTPGRGAAALOX5
SCHEMBL11467078 0.71 MGLL (0.42) ELANEMGLLMAPTALDH1A1KDM4E
SCHEMBL19707564 0.67 ELANE (0.55) CACNA1BAPBA1ELANEF2CTSG
SCHEMBL8306096 0.67 MAPT (0.42) CACNA1BAPBA1ELANEF2CTSG
SCHEMBL17082984 0.67 SMN1; SMN2 (0.44) CACNA1BAPBA1ELANEF2CTSG
SCHEMBL14633824 0.66 MAPK1 (0.41) CACNA1BAPBA1ELANEF2CTSG
SCHEMBL13039115 0.64 POLB (0.67) CACNA1BAPBA1ELANEF2CTSG

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
US-4193922-A HERBICIDES, FUNGICIDES ESZAKMAGYARORSZAGI VEGYIMUVEK (HU) 1980-03-18 US claimed
US-4193922-A HERBICIDES, FUNGICIDES ESZAKMAGYARORSZAGI VEGYIMUVEK (HU) 1980-03-18 US disclosed