SCHEMBL9012301

SCHEMBL9012301

CCc1nc(SCc2ccccc2NC)[nH]c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
HPGD P15428 8/20 0.39
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
GFER P55789 1/20 0.39
GAA P10253 1/20 0.39
POLB P06746 1/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
TP53 P04637 1/20 0.36
BACE1 P56817 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 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
SCHEMBL6475635 0.76 RAB9A (0.68) LMNAHPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL9011940 0.74 POLB (0.40) LMNAHPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL6481930 0.72 HPGD (0.51) LMNAHPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL9695000 0.72 TP53 (0.71) LMNAHPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL9011928 0.72 AR (0.34) GAAAR
SCHEMBL9012067 0.70 HDAC1 (0.46) HPGDALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL6627560 0.68 KMT2A (0.45) LMNAHPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL8658589 0.66 AR (0.33) LMNAHPGDALDH1A1POLBKMT2A
SCHEMBL1682034 0.65 ALDH1A1 (0.50) HPGDALDH1A1GAAPOLBKMT2A
Hydrochloric Acid SCHEMBL2860880 0.64 ALDH1A1 (0.48) HPGDALDH1A1GAAPOLBKMT2A

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