SCHEMBL5010725

SCHEMBL5010725

CCC[CH]c1c(-c2ccccc2-c2ccccc2)ccc2ccccc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.37
GAA P10253 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
DNMT1 P26358 1/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
TSHR P16473 2/20 0.34
CRHR1 P34998 1/20 0.34
PPARG P37231 2/20 0.33
PPARA Q07869 2/20 0.33
CNR1 P21554 2/20 0.33
TNF P01375 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33

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
SCHEMBL5012412 0.92 L3MBTL1 (0.39) L3MBTL1GAATDP1MEN1KMT2A
SCHEMBL5008784 0.89 DNMT1 (0.38) L3MBTL1GAATDP1DNMT1MEN1
SCHEMBL5013832 0.84 CYP2A6 (0.39) L3MBTL1GAATDP1TSHRCNR1
SCHEMBL5010129 0.81 L3MBTL1 (0.39) L3MBTL1GAATDP1MEN1KMT2A
SCHEMBL5013841 0.80 TNF (0.41) L3MBTL1GAATDP1DNMT1MEN1
SCHEMBL5609949 0.74 TSHR (0.47) L3MBTL1GAATDP1MEN1KMT2A
SCHEMBL5013849 0.73 PTGS2 (0.35) ALDH1A1HSD17B10PTGS2HPGDMAPK1
SCHEMBL1610694 0.72 NR1I2 (0.44) L3MBTL1GAATDP1MEN1KMT2A
SCHEMBL5010151 0.72 CYP2A6 (0.42) L3MBTL1GAATDP1DNMT1TSHR
SCHEMBL2354609 0.71 ALDH1A1 (0.41) L3MBTL1TDP1DNMT1MEN1KMT2A

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-20080207864-A1 Organosilanes, Process For Production of the Same, and Use Thereof SHARP KABUSHIKI KAISHA (JP) 2008-08-28 US disclosed