SCHEMBL9013455

SCHEMBL9013455

CN(C)c1ccccc1CSc1ncc[nH]1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HDAC1 Q13547 1/20 0.39
GRIN2B Q13224 2/20 0.38
TAAR1 Q96RJ0 1/20 0.37
GRIN2A Q12879 1/20 0.37
FDPS P14324 1/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GLI1 P08151 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
ATP4A P20648 1/20 0.36
ATP4B P51164 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
SCHEMBL4765782 0.80 HPGD (0.51) LMNAMAPTHPGDMAPK1L3MBTL1
SCHEMBL9870409 0.79 GPR84 (0.47) LMNAPOLBMAPTHPGDTSHR
SCHEMBL4767404 0.78 HPGD (0.40) MAPTHPGDHDAC1GRIN2BTAAR1
SCHEMBL9012401 0.77 HDAC1 (0.52) POLBMAPTHPGDHDAC1GRIN2B
SCHEMBL9012067 0.77 HDAC1 (0.46) HPGDTSHRHDAC1GRIN2BTAAR1
SCHEMBL6483534 0.74 RAB9A (0.64) LMNAMAPTHPGDTSHRMAPK1
SCHEMBL9011939 0.74 HDAC1 (0.45) HPGDTSHRHDAC1GRIN2BTAAR1
SCHEMBL9012190 0.73 HDAC1 (0.44) HPGDTSHRHDAC1GRIN2BGRIN2A
SCHEMBL9695295 0.73 TP53 (0.67) LMNAPOLBHPGDNPSR1GRIN2B
SCHEMBL229404 0.73 HDAC1 (0.53) LMNAHDAC1GRIN2BTAAR1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5523317-A ADMINISTERING IMIDAZOLE DERIVATIVE NIPPON CHEMIPHAR CO., LTD. (JP) 1996-06-04 US disclosed
EP-0354788-B1 Novel imidazole derivatives NIPPON CHEMIPHAR CO (JP) 1995-09-13 EP disclosed
EP-0633026-A1 Use of imidazole derivative for antihypertensive agent NIPPON CHEMIPHAR CO., LTD. (JP) 1995-01-11 EP disclosed
CN-1020902-C IMIDAZOLE DERIVATIVE AND PROCESSES FOR PREPARING SAME TANAHBE SEIYAKU CO LTD (JP) 1993-05-26 CN disclosed
US-5180836-A Antiulcer agents NIPPON CHEMIPHAR CO., LTD. (JP) 1993-01-19 US disclosed
US-5082943-A Antiulcer NIPPON CHEMIPHAR CO., LTD. (JP) 1992-01-21 US disclosed
EP-0354788-A1 Novel imidazole derivatives NIPPON CHEMIPHAR CO., LTD. (JP) 1990-02-14 EP disclosed
CN-87108111-A Novel imidazole derivative and preparation method thereof 1988-09-28 CN disclosed