Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5352807

CC(C)(C)c1ccc(CCc2ccc(C(C)(C)C)c3c2Cc2ccccc2-3)c2c1-c1ccccc1C2.[Cl-].[Cl-].[Zr+2]

nearest known ligand 0.39

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
CHRM2 known ✓ P08172 2/20 0.32
CHRM1 known ✓ P11229 2/20 0.32
CHRM3 known ✓ P20309 2/20 0.32
MAP3K9 P80192 3/20 0.39
MAP3K11 Q16584 3/20 0.39
PNMT P11086 1/20 0.36
DRD2 P14416 3/20 0.33
DRD4 P21917 2/20 0.33
DRD3 P35462 2/20 0.33
CHRM4 P08173 2/20 0.32
CHRM5 P08912 2/20 0.32
NTRK1 P04629 1/20 0.32
KDR P35968 1/20 0.32
MAP3K10 Q02779 1/20 0.32
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30
MAOA P21397 1/20 0.30
NPC1 O15118 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
Hydrochloric Acid SCHEMBL5351379 0.97 MAP3K9 (0.39) MAP3K9MAP3K11PNMTDRD2DRD4
Hydrochloric Acid SCHEMBL7606459 0.90 PNMT (0.36) MAP3K9MAP3K11PNMTDRD2DRD4
SCHEMBL8857105 0.87 MAP3K9 (0.34) MAP3K9MAP3K11PNMTNTRK1KDR
SCHEMBL8857026 0.87 PNMT (0.38) MAP3K9MAP3K11PNMTNPC1RAB9A
SCHEMBL3828187 0.83 PNMT (0.35) MAP3K9MAP3K11PNMTDRD2KDR
SCHEMBL9171570 0.82 MAP3K9 (0.39) MAP3K9MAP3K11PNMTDRD3CHRM2
Hydrochloric Acid SCHEMBL9163302 0.81 MAP3K9 (0.33) MAP3K9MAP3K11PNMT
Hydrochloric Acid SCHEMBL5363324 0.80 PNMT (0.42) MAP3K9MAP3K11PNMTDRD2DRD4
Hydrochloric Acid SCHEMBL5352097 0.79 MAP3K9 (0.38) MAP3K9MAP3K11PNMTDRD3CHRM2
Hydrochloric Acid SCHEMBL27447524 0.79 MAP3K9 (0.38) MAP3K9MAP3K11PNMTCHRM2CHRM4

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
EP-0524624-B1 Use of organometallic flurorenyl compounds. PHILLIPS PETROLEUM CO (US) 2002-05-15 EP claimed
EP-0524624-A2 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1993-01-27 EP claimed
US-7230128-B2 Organometallic fluorenyl compounds, preparations, and use PHILLIPS POTROLEUM COMPANY (US) 2007-06-12 US disclosed
US-20060122344-A1 Organometallic Fluorenyl Compounds, Preparations, and Use PHILLIPS PETROLEUM COMPANY (US) 2006-06-08 US disclosed
US-6420579-B1 SILYL, GERMANIUM OR TIN RADICALS WITH TITANIUM, ZIRCONIUM, HAFNIUM, VANADIUM, NIOBIUM AND TANTALUM METALS PHILLIPS PETROLEUM COMPANY 2002-07-16 US disclosed
US-6403734-B1 POLYMERIZING ALPHA-OLEFIN BY CONTACTING WITH CATALYST SYSTEM COMPRISING BRIDGED FLUORENYL METALLOCENE CONTAINING METAL OF GROUP 4 OR 5 AND SUITABLE COCATALYST PHILLIPS PETROLEUM COMPANY 2002-06-11 US disclosed
EP-0524624-B1 Use of organometallic flurorenyl compounds. PHILLIPS PETROLEUM CO (US) 2002-05-15 EP disclosed
EP-0666267-B1 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM CO (US) 2001-04-18 EP disclosed
US-6162936-A Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 2000-12-19 US disclosed
US-5571880-A CATALYSTS FOR POLYMERIZATION OF OLEFINS ESPECIALLY TO OBTAIN SYNDIOTACTIC POLYMERS PHILLIPS PETROLEUM COMPANY (US) 1996-11-05 US disclosed
EP-0666267-A2 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1995-08-09 EP disclosed
US-5436305-A Preparing polymer catalysts by reaction of alkali metal alkyl and fluorenyl in solvent PHILLIPS PETROLEUM COMPANY (US) 1995-07-25 US disclosed
EP-0524624-A2 Organometallic fluorenyl compounds, preparation, and use PHILLIPS PETROLEUM COMPANY (US) 1993-01-27 EP 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-20060122344-A1 Organometallic Fluorenyl Compounds, Preparations, and Use HMBS, FDPS, SOD1 CHRM2 3235/4885CHRM1 2489/4885CHRM3 1723/4885

“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.