SCHEMBL11244889

SCHEMBL11244889

CC(Sc1ccc(NC(=O)NC(=O)c2ccccc2Cl)cc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.52
▸ PCTP Q9UKL6 1/20 0.50
▸ GCGR P47871 1/20 0.48
▸ RAB9A P51151 5/20 0.48
▸ NPC1 O15118 4/20 0.48
▸ POLB P06746 2/20 0.48
▸ PKM P14618 1/20 0.48
▸ SMO Q99835 4/20 0.48
▸ PYGL P06737 3/20 0.46
▸ PLCG2 P16885 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ GAA P10253 1/20 0.45
▸ RECQL P46063 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ GPR139 Q6DWJ6 1/20 0.44

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
SCHEMBL11236694 0.93 GCGR (0.52) TDP1PCTPGCGRRAB9ANPC1
SCHEMBL11240571 0.88 TDP1 (0.53) TDP1PCTPGCGRRAB9ANPC1
SCHEMBL11252234 0.87 HPGD (0.49) TDP1RAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL11245158 0.86 GCGR (0.54) TDP1PCTPGCGRRAB9ANPC1
SCHEMBL11234133 0.86 NPC1 (0.51) TDP1PCTPGCGRRAB9ANPC1
SCHEMBL11254390 0.86 TDP1 (0.51) TDP1PCTPGCGRRAB9ANPC1
SCHEMBL11245400 0.81 GCGR (0.60) TDP1PCTPGCGRRAB9ANPC1
SCHEMBL11240787 0.81 GCGR (0.53) TDP1PCTPGCGRRAB9ANPC1
SCHEMBL11248363 0.80 ATM (0.51) TDP1RAB9ANPC1POLBPKM
SCHEMBL11137554 0.79 TDP1 (0.57) TDP1PCTPGCGRRAB9ANPC1

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-4350706-A MITICIDES, LARVICIDES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1982-09-21 — — US disclosed
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