SCHEMBL9011970

SCHEMBL9011970

CC(C)(Cl)CNc1ccccc1CSc1ncc[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.41
SMN1; SMN2 Q16637 5/20 0.34
NPC1 O15118 4/20 0.34
RAB9A P51151 4/20 0.34
ALDH1A1 P00352 3/20 0.34
GRIN2B Q13224 2/20 0.34
PKM P14618 1/20 0.33
GRIN2A Q12879 1/20 0.33
HPGD P15428 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TP53 P04637 1/20 0.32
BACE1 P56817 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
ADK P55263 1/20 0.32
FDPS P14324 1/20 0.32
KMT2A Q03164 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL9011939 0.83 HDAC1 (0.45) HDAC1SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL9012040 0.83 HDAC1 (0.38) HDAC1SMN1; SMN2NPC1RAB9AGRIN2B
SCHEMBL9012067 0.80 HDAC1 (0.46) HDAC1SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL9012538 0.80 HDAC1 (0.42) HDAC1SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL9012305 0.79 HDAC1 (0.40) HDAC1SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL9011958 0.79 HDAC1 (0.46) HDAC1GRIN2BPKMGRIN2AHPGD
SCHEMBL9362106 0.78 HDAC1 (0.43) HDAC1SMN1; SMN2ALDH1A1HSD17B10FDPS
SCHEMBL9012190 0.77 HDAC1 (0.44) HDAC1SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL9361383 0.76 HDAC1 (0.42) HDAC1SMN1; SMN2ALDH1A1HPGDHSD17B10
SCHEMBL9361359 0.76 HDAC1 (0.40) HDAC1SMN1; SMN2NPC1RAB9AALDH1A1

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 3 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-0633026-A1 Use of imidazole derivative for antihypertensive agent NIPPON CHEMIPHAR CO., LTD. (JP) 1995-01-11 EP disclosed
EP-0354788-A1 Novel imidazole derivatives NIPPON CHEMIPHAR CO., LTD. (JP) 1990-02-14 EP disclosed