SCHEMBL11235213

SCHEMBL11235213

O=C(NC(=O)c1ccccc1Cl)Nc1ccc(SCc2cccs2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PCTP Q9UKL6 2/20 0.50
▸ TDP1 Q9NUW8 1/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ NPC1 O15118 4/20 0.48
▸ RAB9A P51151 4/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ GCGR P47871 1/20 0.46
▸ LMNA P02545 3/20 0.44
▸ HTT P42858 2/20 0.44
▸ PLCG2 P16885 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ GAA P10253 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ MAPT P10636 2/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ TSHR P16473 1/20 0.42

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
SCHEMBL11247202 0.87 SMN1; SMN2 (0.51) PCTPSMN1; SMN2NPC1RAB9AMEN1
SCHEMBL11242722 0.83 GCGR (0.54) PCTPTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL11236412 0.80 TDP1 (0.57) PCTPTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL11141988 0.78 GCGR (0.60) PCTPTDP1SMN1; SMN2NPC1RAB9A
Chlorbenzuron SCHEMBL5177776 0.77 GCGR (0.68) PCTPTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL11247921 0.76 GCGR (0.59) PCTPTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL10729809 0.73 TDP1 (0.51) PCTPTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL10705754 0.73 GCGR (0.64) PCTPTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL8624438 0.73 TDP1 (0.62) PCTPTDP1SMN1; SMN2NPC1RAB9A
SCHEMBL11238363 0.72 NPC1 (0.54) TDP1SMN1; SMN2NPC1RAB9AMEN1

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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