SCHEMBL11570619

SCHEMBL11570619

Cc1cccc2c1N(C)C(=O)CS2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 1/20 0.44
MEN1 O00255 7/20 0.42
KMT2A Q03164 7/20 0.42
ALDH1A1 P00352 5/20 0.42
POLB P06746 2/20 0.42
LMNA P02545 3/20 0.42
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 4/20 0.38
HTT P42858 2/20 0.38
USP2 O75604 1/20 0.38
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
MAPK1 P28482 1/20 0.38
NPSR1 Q6W5P4 2/20 0.37
GAA P10253 1/20 0.37
TSHR P16473 1/20 0.37
CLK1 P49759 1/20 0.36
HTR7 P34969 1/20 0.36

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
SCHEMBL8140807 0.73 LMNA (0.57) MEN1KMT2AALDH1A1POLBLMNA
SCHEMBL30404908 0.69 KMT2A (0.46) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL11630037 0.69 KMT2A (0.46) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL8555101 0.68 SRD5A1 (0.46) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL26542949 0.68 KCNN4 (0.50) PSMD14ALDH1A1POLBLMNAGSK3A
SCHEMBL8566207 0.67 LMNA (0.43) MEN1KMT2AALDH1A1POLBLMNA
SCHEMBL4193751 0.66 AVPR2 (0.32) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL16079005 0.66 ALDH1A1 (0.38) MEN1KMT2AALDH1A1POLBMAPT
SCHEMBL433871 0.66 LMNA (0.63) MEN1KMT2AALDH1A1POLBLMNA
SCHEMBL9201938 0.66 LMNA (0.65) MEN1KMT2AALDH1A1POLBLMNA

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
JP-54109985-A None JP disclosed
JP-S54109985-A 1,4-BENZOAZINE DERIVATIVE AND BACTERICIDAL AGENT CONTAINING THE SAME IT COMPONENT FOR AGRICULTURE AND FLORICULTURE SUMITOMO CHEM CO LTD 1979-08-29 JP disclosed