SCHEMBL30548744

SCHEMBL30548744

Clc1ccccc1Sc1ccccc1Sc1ccccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.53
LMNA P02545 3/20 0.50
TSHR P16473 1/20 0.50
HAO1 Q9UJM8 1/20 0.50
DHFR P00374 1/20 0.47
PRMT3 O60678 1/20 0.46
CARM1 Q86X55 1/20 0.46
PRMT6 Q96LA8 1/20 0.46
PRMT8 Q9NR22 1/20 0.46
PRMT1 Q99873 1/20 0.43
KDM4E B2RXH2 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPT P10636 2/20 0.43
PKM P14618 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
RXFP1 Q9HBX9 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
SCHEMBL6915666 0.97 RHEB (0.55) RHEBLMNATSHRHAO1DHFR
SCHEMBL29543966 0.97 RHEB (0.55) RHEBLMNATSHRHAO1DHFR
SCHEMBL11148598 0.83 RHEB (0.46) RHEBLMNATSHRHAO1DHFR
SCHEMBL11125922 0.83 ALDH1A1 (0.54) RHEBTSHRHAO1DHFRPRMT3
SCHEMBL11824181 0.83 PDE7A (0.56) RHEBLMNATSHRHAO1DHFR
SCHEMBL3784489 0.81 PDE7A (0.50) RHEBLMNATSHRHAO1PRMT1
SCHEMBL5612266 0.79 HAO1 (0.44) RHEBLMNATSHRHAO1DHFR
SCHEMBL225608 0.79 FBP1 (0.55) RHEBLMNATSHRHAO1NPSR1
SCHEMBL31464849 0.79 FBP1 (0.55) RHEBLMNATSHRHAO1NPSR1
SCHEMBL5090554 0.78 AR (0.50) RHEBLMNAHAO1DHFRPRMT3

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-116657163-A Method for dithioating o-dihalogenated aromatic hydrocarbon 河南大学 2023-08-29 CN disclosed