SCHEMBL4657381

SCHEMBL4657381

c1ccc(-c2nnns2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
ADORA2A P29274 1/20 0.42
ADORA2B P29275 1/20 0.42
ADORA1 P30542 1/20 0.42
RAB9A P51151 4/20 0.40
NPC1 O15118 3/20 0.40
PDPK1 O15530 1/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 2/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
LMNA P02545 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35

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
Water SCHEMBL2703512 0.76 GAA (0.46) RAB9ANPC1MAPK1ALDH1A1POLB
SCHEMBL9018567 0.69 ALDH1A1 (0.61) RAB9ANPC1PDPK1MAPK1ALDH1A1
SCHEMBL2213286 0.67 ALDH1A1 (0.59) RAB9ANPC1PDPK1MAPK1ALDH1A1
SCHEMBL17948201 0.65 ALDH1A1 (0.57) RAB9ANPC1MAPK1ALDH1A1POLB
SCHEMBL7197255 0.60 LMNA (0.56) ADORA2AADORA1RAB9ANPC1MAPK1
SCHEMBL22684941 0.59 TDO2 (0.59) TDO2RAB9ANPC1MAPK1ALDH1A1
SCHEMBL3652642 0.58 NPC1 (1.00) ADORA3ADORA2AADORA2BADORA1RAB9A
Biphenyl SCHEMBL4002609 0.58 ALDH1A1 (1.00) RAB9ANPC1MAPK1ALDH1A1TDP1
Biphenyl SCHEMBL164 0.58 ALDH1A1 (1.00) RAB9ANPC1MAPK1ALDH1A1TDP1
Biphenyl SCHEMBL2548048 0.58 ALDH1A1 (1.00) RAB9ANPC1MAPK1ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116003335-A Method for preparing phenylthio-1, 2, 4-triazole compound by continuous coupling 沈阳化工研究院有限公司 2023-04-25 CN disclosed
CN-109232451-A A method of preparing benzene sulphur azoles 浙江工业大学 2019-01-18 CN disclosed
EP-1520695-B1 Photosensitive composition and image recording material using the same FUJIFILM CORP (JP) 2008-12-10 EP disclosed
US-7244547-B2 Photosensitive composition and image recording material using the same FUJIFILM CORPORATION (JP) 2007-07-17 US disclosed
EP-1516743-B1 Planographic printing plate precursor FUJI PHOTO FILM CO LTD (JP) 2006-12-13 EP disclosed
US-20050100821-A1 Photosensitive composition and image recording material using the same FUJI PHOTO FILM CO., LTD. 2005-05-12 US disclosed
EP-1520695-A2 Photosensitive composition and image recording material using the same FUJI PHOTO FILM CO., LTD. (JP) 2005-04-06 EP disclosed
US-20050064328-A1 Planographic printing plate precursor FUJI PHOTO FILM CO., LTD. 2005-03-24 US disclosed
EP-1516743-A1 Planographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2005-03-23 EP disclosed