Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6330356

CCCOc1ccccc1SC1=C([Ti+2])CC=C1.[Cl-].[Cl-]

nearest known ligand 0.36

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 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 1/20 0.32
SLC6A3 known ✓ Q01959 1/20 0.32
CHRM2 known ✓ P08172 1/20 0.31
CHRM1 known ✓ P11229 1/20 0.31
ACHE known ✓ P22303 1/20 0.31
SLC6A9 P48067 9/20 0.36
HTR2B P41595 2/20 0.33
HTR2C P28335 1/20 0.33
CYP2A6 P11509 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KCNH2 Q12809 2/20 0.32
SLC6A4 P31645 1/20 0.32
MAPT P10636 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PDE5A O76074 1/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 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
Hydrochloric Acid SCHEMBL6338948 0.94 CYP1A2 (0.40) SLC6A9HTR2BCYP1A2CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL6337576 0.91 ALDH1A1 (0.37) SLC6A9HTR2BHTR2CCYP1A2CYP2C19
Hydrochloric Acid SCHEMBL6332931 0.78
Hydrochloric Acid SCHEMBL6330268 0.78
Hydrochloric Acid SCHEMBL6332233 0.78 NISCH (0.33) ACHE
Hydrochloric Acid SCHEMBL6333331 0.74 L3MBTL1 (0.36) HTR2BHTR2CCYP2A6CYP1A2CYP2C9
Hydrochloric Acid SCHEMBL6333776 0.74 PDE5A (0.40) HTR2BHTR2CCYP1A2CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL6337581 0.71 ALDH1A1 (0.37) SLC6A9HTR2BHTR2CMAPTNPSR1
Hydrochloric Acid SCHEMBL6334146 0.70 HTR2B (0.35) HTR2BHTR2CCYP2A6CYP1A2CYP2C9
Hydrochloric Acid SCHEMBL6330160 0.70 CYP1A2 (0.36) HTR2BHTR2CCYP2A6CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6870017-B2 Transition metal compound, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-03-22 US disclosed
US-20030171212-A1 Transition metal compound, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED 2003-09-11 US disclosed
US-6548686-B2 Coordination catalysts; suppresses heat generation SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-04-15 US disclosed
US-20020013433-A1 Transition metal compound, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-31 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 (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-20020013433-A1 Transition metal compound, catalyst for addition polymerization, and process for producing addition polymer ASH2L, ARL1, AS3MT SLC6A2 4111/4885SLC6A3 3943/4885CHRM2 3776/4885

“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.