SCHEMBL9012427

SCHEMBL9012427

CN(C)c1ccccc1CSc1nc2c([nH]1)CCCC2

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.51
LMNA P02545 6/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
TSHR P16473 2/20 0.45
MAPK1 P28482 1/20 0.45
GAA P10253 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
MMP13 P45452 2/20 0.39
MAPT P10636 3/20 0.38
HTT P42858 1/20 0.37
TP53 P04637 1/20 0.36
ACHE P22303 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
SCHEMBL9012048 0.81 HPGD (0.51) HPGDLMNAMEN1KMT2ATSHR
SCHEMBL6481930 0.80 HPGD (0.51) HPGDLMNAMEN1KMT2ATSHR
SCHEMBL9012520 0.75 HPGD (0.47) HPGDLMNAMEN1KMT2ATSHR
SCHEMBL6483534 0.74 RAB9A (0.64) HPGDLMNAMEN1KMT2ATSHR
SCHEMBL10478356 0.73 SMN1; SMN2 (0.47) HPGDLMNAMEN1KMT2ATSHR
SCHEMBL9012107 0.73 ACHE (0.35) HPGDGAAL3MBTL1ACHE
SCHEMBL9678318 0.71 SMN1; SMN2 (0.47) HPGDLMNAMEN1KMT2ACYP1A2
SCHEMBL9838119 0.71 POLB (0.67) HPGDLMNAMEN1KMT2ATSHR
SCHEMBL9677090 0.70 HRH4 (0.55) HPGDLMNAMEN1KMT2ATSHR
SCHEMBL9695295 0.70 TP53 (0.67) HPGDLMNAKMT2ATP53

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 6 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
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