Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6340719

CCOc1ccccc1OC1=C([Ti+2])CC=C1.[Cl-].[Cl-]

nearest known ligand 0.40

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 2/20 0.35
SLC6A3 known ✓ Q01959 2/20 0.35
ALDH1A1 P00352 5/20 0.40
L3MBTL1 Q9Y468 5/20 0.39
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GLA P06280 1/20 0.39
HPGD P15428 2/20 0.38
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
SLC6A4 P31645 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 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
Hydrochloric Acid SCHEMBL6336981 0.88 CYP1A2 (0.43) ALDH1A1L3MBTL1MAPTNPSR1LMNA
Hydrochloric Acid SCHEMBL6334170 0.84 HTT (0.44) ALDH1A1L3MBTL1TDP1ADRA2AADRA2B
Hydrochloric Acid SCHEMBL6330826 0.80
Hydrochloric Acid SCHEMBL6331163 0.77 NQO1 (0.32)
SCHEMBL10998289 0.73 ALDH1A1 (0.60) ALDH1A1L3MBTL1MAPTNPSR1GLA
Hydrochloric Acid SCHEMBL27552459 0.73 L3MBTL1 (0.44) ALDH1A1L3MBTL1MAPTNPSR1LMNA
Hydrochloric Acid SCHEMBL6337576 0.72 ALDH1A1 (0.37) ALDH1A1L3MBTL1MAPTNPSR1GLA
1,2-Diethoxybenzene SCHEMBL578986 0.71 ALDH1A1 (0.68) ALDH1A1L3MBTL1MAPTNPSR1GLA
Hydrochloric Acid SCHEMBL6334274 0.71 ALDH1A1 (0.36) ALDH1A1L3MBTL1MAPTNPSR1GLA
1,2-Diethoxybenzene SCHEMBL29428929 0.71 ALDH1A1 (0.68) ALDH1A1L3MBTL1MAPTNPSR1GLA

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 5 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
CN-1174002-C Transition metal compound, catalyst for polyaddition and method for preparing addition polymer 住友化学工业株式会社 2004-11-03 CN 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 3943/4885ALDH1A1 3244/4885

“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.