SCHEMBL9488183

SCHEMBL9488183

Cc1cccc(Sc2cc(C)cc(C)c2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.57
HTR1A P08908 2/20 0.46
HTR3A P46098 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.42
IDO1 P14902 1/20 0.42
GRM5 P41594 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
HPGD P15428 2/20 0.41
MAPT P10636 2/20 0.41
GFER P55789 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NOTUM Q6P988 1/20 0.40
KDM4E B2RXH2 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTR2C P28335 1/20 0.39
HTR6 P50406 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL10708933 0.93 ACHE (0.46) ACHEHTR1AHTR3ASMN1; SMN2IDO1
SCHEMBL29543680 0.93 ACHE (0.58) ACHEHTR1AHTR3ASMN1; SMN2IDO1
SCHEMBL29468631 0.93 ACHE (0.58) ACHEHTR1AHTR3ASMN1; SMN2IDO1
SCHEMBL575896 0.93 ACHE (0.58) ACHEHTR1AHTR3ASMN1; SMN2IDO1
SCHEMBL10710202 0.88 ACHE (0.52) ACHEHTR1AHTR3ASMN1; SMN2IDO1
SCHEMBL3894284 0.86 ACHE (0.50) ACHEHTR1AHTR3ASMN1; SMN2IDO1
SCHEMBL822376 0.84 ACHE (0.48) ACHEHTR1AHTR3ASMN1; SMN2IDO1
SCHEMBL31038384 0.84 ACHE (0.48) ACHEHTR1AHTR3ASMN1; SMN2IDO1
SCHEMBL11125164 0.84 ACHE (0.48) ACHEHTR1AHTR3ASMN1; SMN2IDO1
SCHEMBL4804097 0.83 ALDH1A1 (0.43) ACHEHTR1AHTR3ASMN1; SMN2ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5250657-A Process for preparing polyarylene thioether SEISAN KAIHATSU KAGAKU KENKYUSHO (JP) 1993-10-05 US disclosed
EP-0440106-A2 Process for preparing polyarylene thioethers SEISAN KAIHATSU KAGAKU KENKYUSHO (JP) 1991-08-07 EP disclosed