SCHEMBL5195722

SCHEMBL5195722

CCNCC(F)Nc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.43
▸ ALDH1A1 P00352 5/20 0.38
▸ TSHR P16473 4/20 0.38
▸ CYP3A4 P08684 3/20 0.38
▸ ALOX15 P16050 3/20 0.38
▸ HSD17B10 Q99714 3/20 0.38
▸ LMNA P02545 3/20 0.38
▸ ALOX12 P18054 2/20 0.38
▸ THRB P10828 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ RECQL P46063 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ HIF1A Q16665 3/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HTT P42858 1/20 0.35
▸ MAPT P10636 3/20 0.34
▸ GAA P10253 3/20 0.34
▸ GALR3 O60755 1/20 0.34
▸ SLC6A2 P23975 2/20 0.33
▸ SLC6A4 P31645 2/20 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
SCHEMBL29460268 0.79 TDP1 (0.50) TDP1ALDH1A1TSHRCYP3A4ALOX15
SCHEMBL1804931 0.76 TDP1 (0.46) TDP1ALDH1A1TSHRCYP3A4ALOX15
SCHEMBL27914667 0.76 MAPT (0.47) TDP1CYP3A4LMNATHRBL3MBTL1
SCHEMBL17711573 0.70 HDAC8 (0.43) TDP1ALDH1A1MAPK1HTTMAPT
SCHEMBL12231496 0.69 GRIN1 (0.57) TDP1CYP3A4LMNAL3MBTL1HIF1A
SCHEMBL21637581 0.68 TDP1 (0.64) TDP1ALDH1A1TSHRCYP3A4ALOX15
SCHEMBL8346697 0.67 MAPT (0.56) TDP1ALDH1A1TSHRCYP3A4LMNA
SCHEMBL28255718 0.67 TDP1 (0.45) TDP1ALDH1A1TSHRCYP3A4ALOX15
SCHEMBL2020475 0.67 TDP1 (0.55) TDP1ALDH1A1TSHRCYP3A4ALOX15
SCHEMBL2495982 0.66 TDP1 (0.54) TDP1ALDH1A1TSHRCYP3A4ALOX15

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
EP-1812242-A1 SHEET PRODUCT FOR THERMAL PRINTING AND FOR MAGNETIC RECORDING Arjo Wiggins Limited (GB) 2007-08-01 — — EP disclosed
WO-2006043044-A1 SHEET PRODUCT FOR THERMAL PRINTING AND FOR MAGNETIC RECORDING ARJO WIGGINS LIMITED (GB) 2006-04-27 — — WO disclosed
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