SCHEMBL9843347

SCHEMBL9843347

[c]1ccccc1SCc1ccco1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.42
TSHR P16473 4/20 0.36
NPSR1 Q6W5P4 2/20 0.35
PKM P14618 1/20 0.35
ALDH1A1 P00352 9/20 0.35
POLB P06746 5/20 0.35
MAPT P10636 5/20 0.35
TDP1 Q9NUW8 2/20 0.35
KMT2A Q03164 2/20 0.35
HPGD P15428 4/20 0.34
METAP2 P50579 1/20 0.34
NPC1 O15118 4/20 0.33
RAB9A P51151 4/20 0.33
HSD17B10 Q99714 2/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
MITF O75030 1/20 0.32

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
SCHEMBL8995181 0.74
SCHEMBL8731748 0.73 ALDH1A1 (0.35) TSHRNPSR1ALDH1A1POLBMAPT
SCHEMBL4302 0.72 POLB (0.44) ALDH1A1POLBTDP1NPC1RAB9A
SCHEMBL10546461 0.72 HPGD (0.53) RXFP1TSHRNPSR1PKMALDH1A1
SCHEMBL4613873 0.71 ALDH1A1 (0.39) RXFP1TSHRNPSR1PKMALDH1A1
SCHEMBL9192338 0.71
SCHEMBL1119600 0.69
SCHEMBL5759284 0.69 GAA (0.47) TSHRNPSR1ALDH1A1POLBMAPT
SCHEMBL3678577 0.69
SCHEMBL891217 0.68 TSHR (0.46) TSHRNPSR1ALDH1A1POLBMAPT

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
EP-0435794-A1 Alkenyl- or heteroaryl thio, sulfone, sulfoxy herbicides RHONE-POULENC AGROCHIMIE (FR) 1991-07-03 EP disclosed