Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3078672

C[Si](C)(Cl)C1=C([Cr+2])C(c2cccc3cccnc23)c2c1ccc1ccccc21.[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
CCR1 P32246 5/20 0.36
CCR8 P51685 5/20 0.36
LMNA P02545 4/20 0.36
KDM4E B2RXH2 4/20 0.36
CCR5 P51681 3/20 0.36
MAPT P10636 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
CYP3A4 P08684 2/20 0.36
ALOX15 P16050 2/20 0.36
TSHR P16473 2/20 0.36
HTT P42858 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
GMNN O75496 1/20 0.36
TP53 P04637 1/20 0.36
HSP90AA1 P07900 1/20 0.36
MMP2 P08253 1/20 0.36
CYP2D6 P10635 1/20 0.36
MMP9 P14780 1/20 0.36
NFKB1 P19838 1/20 0.36
MMP8 P22894 1/20 0.36

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 SCHEMBL1069659 0.79 CCR1 (0.40) CCR1CCR8LMNAKDM4ECCR5
Hydrochloric Acid SCHEMBL819992 0.74 KDM4E (0.38) CCR1CCR8LMNAKDM4ECCR5
Hydrochloric Acid SCHEMBL5006798 0.72 PAX8 (0.36) CCR1CCR8LMNAKDM4ECCR5
Hydrochloric Acid SCHEMBL1074386 0.71 LMNA (0.39) CCR1CCR8LMNAKDM4ECCR5
SCHEMBL28517555 0.67 KDM4E (0.54) CCR1CCR8LMNAKDM4ECCR5
Phenanthrene SCHEMBL16685315 0.66 CCR1 (0.76) CCR1CCR8LMNAKDM4ECCR5
Hydrochloric Acid SCHEMBL1071469 0.65 SMN1; SMN2 (0.43) CCR1CCR8LMNAKDM4ECCR5
1-Naphthoquinoline SCHEMBL29533982 0.62 LMNA (0.69) CCR1CCR8LMNAKDM4ECCR5
1-Naphthoquinoline SCHEMBL15106 0.62 LMNA (0.69) CCR1CCR8LMNAKDM4ECCR5
Phenanthroline SCHEMBL27963464 0.62 CCR1 (0.94) CCR1CCR8LMNAKDM4ECCR5

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-7795167-B2 Cyclopentadienyl complexes of group 6 substituted by silyl halides BASELL POLYOLEFINE GMBH (DE) 2010-09-14 US disclosed
EP-1778400-B1 CYCLOPENTADIENYL COMPLEXES OF GROUP 6 SUBSTITUTED BY SILYL HALIDES BASELL POLYOLEFINE GMBH (DE) 2009-05-06 EP disclosed
US-20080097053-A1 Cyclopentadienyl Complexes Of Group 6 Substituted By Silyl Halides BASELL POLYOLEFINE GMBH (DE) 2008-04-24 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-20080097053-A1 Cyclopentadienyl Complexes Of Group 6 Substituted By Silyl Halides INTS6, PORCN, ORC3 CCR1 327/4885CCR8 835/4885LMNA 3133/4885

“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.