Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7869576

CC1=C(C)C(C)(C)C([Ir+3])=C1C.[Cl-].[Cl-].[Cl-]

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.35

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
Ammonia Solution, Strong SCHEMBL16295994 0.94 CTSD (0.32) CTSD
SCHEMBL2230540 0.75 CTSD (0.43) CTSD
Hydrochloric Acid SCHEMBL9079390 0.71 CTSD (0.32) CTSD
Hydrochloric Acid SCHEMBL708751 0.71 CTSD (0.37) CTSD
SCHEMBL27712901 0.69 CTSD (0.35) CTSD
SCHEMBL2509325 0.69 CTSD (0.35) CTSD
SCHEMBL28961651 0.67 CTSD (0.38) CTSD
Hydrochloric Acid SCHEMBL9247457 0.67 CTSD (0.33) CTSD
Hydrochloric Acid SCHEMBL22660514 0.67 CTSD (0.33) CTSD
Hydrochloric Acid SCHEMBL1539601 0.67 CTSD (0.33) CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170081278-A1 Novel compounds GLAXO GROUP LIMITED (GB) 2017-03-23 US disclosed
US-9540318-B2 Sulfonamide compounds and their use in the modulation retinoid-related orphan receptor GLAXO GROUP LIMITED (GB) 2017-01-10 US disclosed
US-20160304478-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2016-10-20 US disclosed
US-9428452-B2 Compounds GLAXO GROUP LIMITED (GB) 2016-08-30 US disclosed
US-20150361039-A1 SULFONAMIDE COMPOUNDS AND THEIR USE IN THE MODULATION RETINOID-RELATED ORPHAN RECEPTOR GLAXO GROUP LIMITED (GB) 2015-12-17 US disclosed
US-9150508-B2 Sulfonamide compounds and their use in the modulation retinoid-related orphan receptor GLAXO GROUP LIMITED (GB) 2015-10-06 US disclosed
US-20150080369-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2015-03-19 US disclosed
EP-2841416-A1 NOVEL COMPOUNDS Glaxo Group Limited (GB) 2015-03-04 EP disclosed
US-20140243362-A1 SULFONAMIDE COMPOUNDS AND THEIR USE IN THE MODULATION RETINOID-RELATED ORPHAN RECEPTOR GLAXO GROUP LIMITED (GB) 2014-08-28 US disclosed
EP-2760443-A1 SULFONAMIDE COMPOUNDS AND THEIR USE IN THE MODULATION RETINOID - RELATED ORPHAN RECEPTOR Glaxo Group Limited (GB) 2014-08-06 EP disclosed
WO-2013160418-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-10-31 WO disclosed
WO-2013045431-A1 SULFONAMIDE COMPOUNDS AND THEIR USE IN THE MODULATION RETINOID - RELATED ORPHAN RECEPTOR GLAXO GROUP LIMITED (GB) 2013-04-04 WO disclosed
US-6303805-B1 COMPLEX FOR OLEFIN OR STYRENE POLYMERIZATION PREPARED BY REACTING TRANSITION METAL COMPLEX AND COMPOUND HAVING AT LEAST TWO FUNCTIONAL GROUPS, HAVING STRUCTURE IN WHICH ANCILLARY LIGANDS OF COMPLEX ARE BRIDGED WITH SAID FUNCTIONAL GROUP SAMSUNG GENERAL CHEMICAL CO., LTD. (KR) 2001-10-16 US 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 (5 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-20150080369-A1 NOVEL COMPOUNDS RORC, RORB, RORA CTSD 4091/4885
US-20170081278-A1 Novel compounds RORC, RORB, RORA CTSD 4091/4885
US-20150361039-A1 SULFONAMIDE COMPOUNDS AND THEIR USE IN THE MODULATION RETINOID-RELATED ORPHAN RECEPTOR RORA, RORC, RORB CTSD 4134/4885
US-20140243362-A1 SULFONAMIDE COMPOUNDS AND THEIR USE IN THE MODULATION RETINOID-RELATED ORPHAN RECEPTOR RORA, RORB, RORC CTSD 4288/4885
US-20160304478-A1 NOVEL COMPOUNDS RORC, RORB, RORA CTSD 4091/4885

“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.