SCHEMBL11089246

SCHEMBL11089246

CCOC(=O)Cc1c(CCNc2cccs2)[nH]c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.50
LMNA P02545 2/20 0.50
ALDH1A1 P00352 6/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
MAPT P10636 3/20 0.46
PPARG P37231 1/20 0.46
NCOA2 Q15596 1/20 0.46
NCOA1 Q15788 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46
PKM P14618 1/20 0.41
KLK6 Q92876 1/20 0.41
HTR6 P50406 2/20 0.41
PABPC1 P11940 1/20 0.41
ALOX15 P16050 1/20 0.41
NPC1 O15118 1/20 0.41
EGFR P00533 3/20 0.41
GAA P10253 2/20 0.41
HSD17B10 Q99714 3/20 0.40

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
SCHEMBL11079968 0.78 KDM4E (0.53) KDM4ELMNAALDH1A1MEN1KMT2A
SCHEMBL11084373 0.78 HTR6 (0.62) KDM4ELMNAALDH1A1MEN1KMT2A
SCHEMBL11866647 0.76 HTR6 (0.63) KDM4ELMNAALDH1A1MEN1KMT2A
SCHEMBL19193162 0.75 KDM4E (0.60) KDM4ELMNAALDH1A1MEN1KMT2A
SCHEMBL11081577 0.75 KDM4E (0.54) KDM4ELMNAALDH1A1MEN1KMT2A
SCHEMBL1165573 0.75 KDM4E (0.68) KDM4ELMNAALDH1A1MAPTPKM
SCHEMBL31487317 0.75 KDM4E (0.68) KDM4ELMNAALDH1A1MAPTPKM
SCHEMBL11625839 0.73 KDM4E (0.57) KDM4ELMNAALDH1A1MEN1KMT2A
SCHEMBL5198795 0.71 KDM4E (0.64) KDM4ELMNAALDH1A1MEN1KMT2A
SCHEMBL735160 0.71 KDM4E (0.54) KDM4ELMNAALDH1A1MEN1KMT2A

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
US-4444768-A ICE CREAM CONE WRAPPER CIBA-GEIGY CORPORATION (US) 1984-04-24 US disclosed