Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1326841

CC1=Cc2c(cccc2C(C)C(=O)N[Ti+2])C1.[Cl-].[Cl-]

nearest known ligand 0.34

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 4)

geneUniProtsupporting neighboursconfidence
CXCL8 P10145 5/20 0.34
GRM7 Q14831 2/20 0.31
GLS O94925 1/20 0.30
LMNA P02545 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
SCHEMBL1326840 0.81 CXCL8 (0.35) CXCL8GRM7GLS
SCHEMBL7047520 0.73 GABRA1 (0.40) LMNA
SCHEMBL4652575 0.69
Hydrochloric Acid SCHEMBL1321778 0.64 RAB9A (0.33)
SCHEMBL17034697 0.63 TDP2 (0.35)
SCHEMBL13265590 0.63
Hydrochloric Acid SCHEMBL1326838 0.62 SIGMAR1 (0.33)
SCHEMBL30477217 0.62 CYP2A6 (0.36)
SCHEMBL26606302 0.62 MAOA (0.34)
SCHEMBL4035804 0.62 CYP2A6 (0.36)

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
EP-2368896-B1 Mono-indenyl transition metal compounds and polymerization therewith EXXONMOBIL CHEM PATENTS INC (US) 2016-08-24 EP disclosed
US-8058461-B2 Mono-indenyl transition metal compounds and polymerization therewith EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-11-15 US disclosed
EP-2368896-A1 Mono-indenyl transition metal compounds and polymerization therewith ExxonMobil Chemical Patents Inc. (US) 2011-09-28 EP disclosed
US-20110213109-A1 Mono-Indenyl Transition Metal Compounds and Polymerization Therewith EXXONMOBIL CHEMICAL PATENTS INC. 2011-09-01 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-20110213109-A1 Mono-Indenyl Transition Metal Compounds and Polymerization Therewith ICMT, TERT, PIN1 CXCL8 3139/4885GRM7 4339/4885GLS 4751/4885

“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.