SCHEMBL17652444

SCHEMBL17652444

O=C1N[C@H]2[C@H](CS[C@H]2CCCCCNCCCCCCNCCCCCC(=O)ON2C(=O)CCC2=O)N1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 6/20 0.63
▸ MEN1 O00255 1/20 0.56
▸ ABL1 P00519 1/20 0.56
▸ LMNA P02545 1/20 0.56
▸ PKM P14618 1/20 0.56
▸ IDE P14735 1/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ RIN1 Q13671 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ HLCS P50747 6/20 0.52
▸ PLCD1 P51178 1/20 0.46
▸ HPSE Q9Y251 1/20 0.46
▸ CA12 O43570 1/20 0.45
▸ CA1 P00915 1/20 0.45
▸ CA2 P00918 1/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ F2 P00734 1/20 0.45
▸ PRSS1 P07477 1/20 0.45
▸ PRSS2 P07478 1/20 0.45

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
SCHEMBL16625034 0.93 TDP1 (0.69) TDP1MEN1ABL1LMNAPKM
SCHEMBL19627566 0.93 TDP1 (0.69) TDP1MEN1ABL1LMNAPKM
SCHEMBL10029433 0.93 TDP1 (0.69) TDP1MEN1ABL1LMNAPKM
SCHEMBL12424059 0.93 TDP1 (0.69) TDP1MEN1ABL1LMNAPKM
SCHEMBL12010938 0.93 TDP1 (0.69) TDP1MEN1ABL1LMNAPKM
SCHEMBL17170012 0.93 TDP1 (0.69) TDP1MEN1ABL1LMNAPKM
SCHEMBL3431980 0.93 TDP1 (0.69) TDP1MEN1ABL1LMNAPKM
SCHEMBL13065000 0.93 TDP1 (0.69) TDP1MEN1ABL1LMNAPKM
SCHEMBL81912 0.93 TDP1 (0.69) TDP1MEN1ABL1LMNAPKM
SCHEMBL10140187 0.91 TDP1 (0.62) TDP1MEN1ABL1LMNAPKM

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-3201235-A1 ANTIBODIES TO TICAGRELOR AND METHODS OF USE Medimmune Limited (GB) 2017-08-09 — — EP disclosed
WO-2016050867-A1 ANTIBODIES TO TICAGRELOR AND METHODS OF USE MEDIMMUNE LIMITED (GB) 2016-04-07 — — WO disclosed
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