Chloral Hydrate

Chloral Hydrate

SCHEMBL1551518

CC(=O)NCC(N)=O.OC(O)C(Cl)(Cl)Cl

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
F2 P00734 1/20 0.35
METAP1 P53582 1/20 0.34
KDM4E B2RXH2 1/20 0.32
MAPK1 P28482 1/20 0.32
HIF1A Q16665 1/20 0.32
PAOX Q6QHF9 2/20 0.31
CYP2C19 P33261 1/20 0.31
TSHR P16473 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
CRBN Q96SW2 1/20 0.30

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
SCHEMBL292864 0.82
Trichlorethanol SCHEMBL29488695 0.82 KDM4E (0.33) KDM4EMAPK1HIF1APAOXTSHR
Bromide SCHEMBL5490789 0.80
Hydrochloric Acid SCHEMBL6045193 0.80
Water SCHEMBL1551519 0.78 MAOA (0.33) METAP1KDM4EMAPK1HIF1APAOX
SCHEMBL20880632 0.74 F2 (0.38) LMNAF2KDM4EMAPK1HIF1A
Chloral Hydrate SCHEMBL5474333 0.71 LMNA (0.50) LMNAKDM4ECYP2C19
SCHEMBL11338422 0.68 CYP2C19 (0.42) KDM4EMAPK1HIF1APAOXCYP2C19
Chloral Hydrate SCHEMBL28464822 0.67 LMNA (0.60) LMNACYP2C19TSHR
SCHEMBL7769403 0.67 LMNA (0.34) LMNATSHRMAOAMAOB

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 103 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120095104-A1 USE OF VASOCONSTRICTORS ZACHAR ORON (IL) 2012-04-19 US claimed
EP-2376073-A2 DERMAL APPLICATION OF VASOCONSTRICTORS Zachar, Oron (IL) 2011-10-19 EP claimed
US-20110144209-A1 USE OF VASOCONSTRICTORS ZACHAR ORON 2011-06-16 US claimed
EP-2313037-A1 DERMAL APPLICATION OF VASOCONSTRICTORS Zachar, Oron (IL) 2011-04-27 EP claimed
WO-2010063030-A2 DERMAL APPLICATION OF VASOCONSTRICTORS FEIGELSON, DANIEL (IL) 2010-06-03 WO claimed
WO-2010001391-A1 DERMAL APPLICATION OF VASOCONSTRICTORS ZACHAR ORON (IL) 2010-01-07 WO claimed
WO-2024197124-A9 ARGININE VASOPRESSIN RECEPTOR (AVPR) ANTAGONISTS AND METHODS OF USING THEREOF UNIVERSITY OF MIAMI (US) 2024-12-19 WO disclosed
WO-2024197124-A2 ARGININE VASOPRESSIN RECEPTOR (AVPR) ANTAGONISTS AND METHODS OF USING THEREOF UNIVERSITY OF MIAMI (US) 2024-09-26 WO disclosed
WO-2022160065-A1 FORMULATIONS INCLUDING DIHYDROHONOKIOL BETTERLIFE PHARMA INC. (CA) 2022-08-04 WO disclosed
EP-3724192-B1 TRIAZOLOBENZAZEPINES AS VASOPRESSIN V1A RECEPTOR ANTAGONISTS RICHTER GEDEON NYRT (HU) 2022-08-03 EP disclosed
US-11298363-B2 Triazolobenzazepines as vasopressin V1a receptor antagonists RICHTER GEDEON NYRT. (HU) 2022-04-12 US disclosed
US-20200368169-A1 ABUSE-DETERRENT COMPOSITIONS PATHEON SOFTGELS INC (US) 2020-11-26 US disclosed
EP-3724192-A1 TRIAZOLOBENZAZEPINES AS VASOPRESSIN V1A RECEPTOR ANTAGONISTS Richter Gedeon Nyrt. (HU) 2020-10-21 EP disclosed
WO-2010088911-A1 PHARMACEUTICAL COMPOSITIONS RESISTANT TO ABUSE EGALET A/S (DK) 2010-08-12 WO disclosed
WO-2010089132-A1 IMMEDIATE RELEASE COMPOSITION RESISTANT TO ABUSE BY INTAKE OF ALCOHOL EGALET A/S (DK) 2010-08-12 WO disclosed
WO-2010083843-A1 CONTROLLED RELEASE FORMULATIONS WITH CONTINUOUS EFFICACY EGALET A/S (DK) 2010-07-29 WO disclosed
WO-2010063030-A2 DERMAL APPLICATION OF VASOCONSTRICTORS FEIGELSON, DANIEL (IL) 2010-06-03 WO disclosed
EP-2155167-A2 CONTROLLED RELEASE PHARMACEUTICAL COMPOSITIONS FOR PROLONGED EFFECT Egalet A/S (DK) 2010-02-24 EP disclosed
WO-2010001391-A1 DERMAL APPLICATION OF VASOCONSTRICTORS ZACHAR ORON (IL) 2010-01-07 WO disclosed
WO-2008148798-A2 CONTROLLED RELEASE PHARMACEUTICAL COMPOSITIONS FOR PROLONGED EFFECT EGALET A/S (DK) 2008-12-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11298363-B2 Triazolobenzazepines as vasopressin V1a receptor antagonists AVPR1B, AVPR1A, AVPR2 LMNA 1867/4885F2 808/4885METAP1 2453/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.