Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6909656

Cc1cccc(N(C)C)c1O[Zr+2]Oc1c(C)cccc1N(C)C.[Cl-].[Cl-]

nearest known ligand 0.38

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
MAPT P10636 3/20 0.38
GAA P10253 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
SCN4A P35499 7/20 0.33
TSHR P16473 4/20 0.32
LMNA P02545 3/20 0.32
CYP1A2 P05177 3/20 0.32
SCN1A P35498 2/20 0.32
SCN5A Q14524 2/20 0.32
SCN9A Q15858 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2D6 P10635 2/20 0.32
NFKB1 P19838 2/20 0.32
CYP2C9 P11712 1/20 0.32
KCNK3 O14649 1/20 0.32
CACNA1F O60840 1/20 0.32
KCNK2 O95069 1/20 0.32

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 SCHEMBL27616261 0.81 SCN4A (0.41) KDM4EADRA2AADRA2BADRA2CSCN4A
SCHEMBL25066429 0.78 MAPT (0.41) MAPTGAAKDM4EADRA2AADRA2B
Hydrochloric Acid SCHEMBL6909074 0.77 TSHR (0.35) MAPTGAAKDM4EADRA2AADRA2B
Hydrochloric Acid SCHEMBL6902147 0.77 CA2 (0.35) MAPTGAAKDM4ETSHRALDH1A1
Nitrogen SCHEMBL10979264 0.74 MAPT (0.39) MAPTGAAKDM4EADRA2AADRA2B
Hydrochloric Acid SCHEMBL6909665 0.73 MAPT (0.38) MAPTGAAKDM4EADRA2AADRA2B
SCHEMBL6909663 0.72 KDM4E (0.36) MAPTGAAKDM4EADRA2AADRA2B
Hydrochloric Acid SCHEMBL6908453 0.69 MAPT (0.38) MAPTGAAKDM4ETSHRLMNA
SCHEMBL23222265 0.69 MAPT (0.38) MAPTGAAKDM4ESCN4ATSHR
Hydrochloric Acid SCHEMBL6906559 0.69 POLB (0.34) KDM4EADRA2AADRA2BADRA2CTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6730626-B2 TRANSITION METAL DERIVATIVE CAN REACT TO FORM AN IONIC COMPLEX WITH THE ALUMINOXANE IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2004-05-04 US disclosed
EP-1323723-A1 TRANSITION METAL COMPOUNDS, POLYMERIZATION CATALYSTS FOR OLEFINS, OLEFIN POLYMERS AND PROCESS FOR THEIR PRODUCTION IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2003-07-02 EP disclosed
US-20020193536-A1 Transition metal compound, polymerization catalysts for olefins, olefin polymers and process for their production IDEMITSU KOSAN CO. LTD. (JP) 2002-12-19 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-20020193536-A1 Transition metal compound, polymerization catalysts for olefins, olefin polymers and process for their production CCNE2, PYM1, AP1M1 MAPT 2296/4885GAA 4417/4885KDM4E 655/4885

“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.