SCHEMBL21715591

SCHEMBL21715591

C=C(C)c1ccc(SC)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.48
NOS3 P29474 2/20 0.45
NOS1 P29475 2/20 0.45
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 5/20 0.41
HPGD P15428 4/20 0.41
HSD17B10 Q99714 2/20 0.41
LMNA P02545 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HAO1 Q9UJM8 1/20 0.39
MAPT P10636 2/20 0.38
RAB9A P51151 2/20 0.38
NFKB1 P19838 2/20 0.38
GAA P10253 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
TAS1R3 Q7RTX0 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
SCHEMBL56361 0.81 MAPT (0.40) MEN1KMT2AALDH1A1HPGDHSD17B10
SCHEMBL22417610 0.80 HPGD (0.39) PLK1ALDH1A1HPGDLMNAL3MBTL1
SCHEMBL14527842 0.78 HPGD (0.38) ALDH1A1HPGDLMNAL3MBTL1
SCHEMBL28660752 0.78 MAPT (0.38) MEN1KMT2AALDH1A1HPGDHSD17B10
SCHEMBL7596929 0.78 MAPT (0.38) MEN1KMT2AALDH1A1HPGDHSD17B10
SCHEMBL19392552 0.76 PLK1 (0.41) PLK1NOS3NOS1MEN1KMT2A
SCHEMBL195321 0.75 HPGD (0.70) PLK1NOS3NOS1MEN1KMT2A
SCHEMBL20290442 0.75 PLK1 (0.44) PLK1NOS3NOS1MEN1KMT2A
SCHEMBL20290429 0.75 PLK1 (0.44) PLK1NOS3NOS1MEN1KMT2A
SCHEMBL16795588 0.75 PLK1 (0.44) PLK1NOS3NOS1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119684346-A Preparation method of selective beta-silicon-based aryl acetic acid compound 扬州大学 2025-03-25 CN disclosed
CN-119192226-A Method for synthesizing photocatalytic organic germanide 延安大学 2024-12-27 CN disclosed
WO-2021133735-A1 RESIN COMPOSITION AND FLOW CELLS INCORPORATING THE SAME ILLUMINA, INC. (US) 2021-07-01 WO disclosed
WO-2020033317-A1 PIPERAZINE-2,5-DIONES AS TGF-BETA INHIBITORS SOUTHERN RESEARCH INSTITUTE (US) 2020-02-13 WO disclosed