Chloral Hydrate

Chloral Hydrate

SCHEMBL6624035

O=C(NC(O)C(Cl)(Cl)Cl)c1ccccc1.OC(O)C(Cl)(Cl)Cl

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.65
LMNA P02545 4/20 0.60
ALDH1A1 P00352 7/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
SMN1; SMN2 Q16637 3/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C19 P33261 1/20 0.53
TRPA1 O75762 1/20 0.50
MAPT P10636 1/20 0.49
KDM4E B2RXH2 3/20 0.49
ATM Q13315 1/20 0.49
CTRB1 P17538 3/20 0.45
SLC1A2 P43004 1/20 0.45
GAA P10253 1/20 0.45
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
HDAC3 O15379 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44

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
SCHEMBL4679419 0.96 HPGD (0.69) HPGDLMNAALDH1A1MEN1KMT2A
SCHEMBL4682432 0.80 HPGD (0.72) HPGDLMNAALDH1A1SMN1; SMN2TRPA1
SCHEMBL10805990 0.79 HPGD (0.65) HPGDLMNAALDH1A1MEN1KMT2A
SCHEMBL12877951 0.79 HPGD (0.70) HPGDLMNAALDH1A1MEN1KMT2A
SCHEMBL4682438 0.79 HPGD (0.70) HPGDLMNAALDH1A1MEN1KMT2A
SCHEMBL4679490 0.79 HPGD (1.00) HPGDLMNAALDH1A1MEN1KMT2A
SCHEMBL1242290 0.79 HPGD (0.70) HPGDLMNAALDH1A1KMT2ASMN1; SMN2
SCHEMBL4682930 0.78 LMNA (0.64) HPGDLMNAALDH1A1MEN1KMT2A
SCHEMBL6560658 0.78 LMNA (0.50) HPGDLMNAALDH1A1MEN1KMT2A
SCHEMBL10811292 0.77 CYP3A4 (0.59) HPGDLMNAALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1392655-A2 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2004-03-03 EP disclosed
WO-2002062762-A2 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2002-08-15 WO disclosed