SCHEMBL31336657

SCHEMBL31336657

Cc1cccc(SCCOc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ DRD2 P14416 3/20 0.53
▸ DRD4 P21917 3/20 0.53
▸ MAPK1 P28482 1/20 0.51
▸ AR P10275 5/20 0.51
▸ NPC1 O15118 2/20 0.50
▸ LMNA P02545 2/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ RAB9A P51151 1/20 0.49
▸ DRD3 P35462 1/20 0.48
▸ MAPT P10636 2/20 0.47
▸ TP53 P04637 1/20 0.47
▸ ATM Q13315 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL9808023 0.82 ALDH1A1 (0.61) TDP1DRD2DRD4MAPK1AR
SCHEMBL10345764 0.81 DRD2 (0.50) DRD2DRD4LMNADRD3MAPT
SCHEMBL10345792 0.81 DRD2 (0.68) DRD2DRD4MAPK1ARNPC1
SCHEMBL9808032 0.81 DRD2 (0.69) DRD2DRD4ARNPC1LMNA
SCHEMBL30753697 0.80 ALDH1A1 (0.50) POLBMAPK1NPC1ALDH1A1L3MBTL1
SCHEMBL2063136 0.78 DRD2 (0.72) TDP1DRD2DRD4MAPK1NPC1
SCHEMBL5686017 0.78 DRD2 (0.72) TDP1DRD2DRD4MAPK1NPC1
SCHEMBL9778731 0.78 MAPT (0.43) POLBTDP1DRD2DRD4MAPK1
SCHEMBL20005794 0.76 POLB (0.57) POLBTDP1DRD2DRD4MAPK1
SCHEMBL5825769 0.76 POLB (0.57) POLBTDP1DRD2DRD4MAPK1

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
CN-119352051-A Method for preparing sulfoxide by electrocatalytic oxidation of thioether with heterogeneous catalyst with high Faraday efficiency 齐鲁工业大学(山东省科学院) 2025-01-24 — — CN disclosed
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