Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3672197

CC1=C(C)C(C)(C)C([Ti+](Oc2ccccc2C)Oc2ccccc2C)=C1C.[Cl-]

nearest known ligand 0.33

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 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PPARG P37231 1/20 0.31
BCHE P06276 1/20 0.31
NISCH Q9Y2I1 1/20 0.31

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 SCHEMBL3668626 0.82 NISCH (0.35) MEN1TSHRKMT2ANISCH
Hydrochloric Acid SCHEMBL346593 0.82 ADRA2A (0.34) RAB9ASMN1; SMN2NISCH
Hydrochloric Acid SCHEMBL8762954 0.80 CA4 (0.30)
Hydrochloric Acid SCHEMBL15122062 0.75 BACE1 (0.36) RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL618964 0.70 KDM4E (0.31) SMN1; SMN2
Hydrochloric Acid SCHEMBL5729183 0.69
Hydrochloric Acid SCHEMBL7931040 0.68 TSHR (0.40) MEN1NPC1TSHRRAB9AKMT2A
Hydrochloric Acid SCHEMBL3615425 0.68 MEN1 (0.33) MEN1NPC1TSHRRAB9AKMT2A
Hydrochloric Acid SCHEMBL3615426 0.65 MEN1 (0.33) MEN1NPC1TSHRRAB9AKMT2A
Hydrochloric Acid SCHEMBL5898891 0.62 CTSD (0.31)

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
EP-2225251-B1 TRANSITION METAL COMPLEXES, CATALYSTS COMPOSITION CONTAINING THE SAME, AND PROCESS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND ALPHA-OLEFINS USING THE SAME SABIC SK NEXLENE COMPANY PTE LTD (SG) 2015-12-23 EP disclosed
US-8344081-B2 Transition metal complexes, catalysts composition containing the same, and process for preparing ethylene homopolymers or copolymers of ethylene and alpha-olefins using the same SK INNOVATION CO., LTD. (KR) 2013-01-01 US disclosed
US-20100298512-A1 TRANSITION METAL COMPLEXES, CATALYSTS COMPOSITION CONTAINING THE SAME, AND PROCESS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND ALPHA-OLEFINS USING THE SAME SK ENERGY CO., LTD. (KR) 2010-11-25 US disclosed
EP-2225251-A1 TRANSITION METAL COMPLEXES, CATALYSTS COMPOSITION CONTAINING THE SAME, AND PROCESS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND ALPHA-OLEFINS USING THE SAME SK Energy Co., Ltd. (KR) 2010-09-08 EP disclosed
WO-2009084805-A1 TRANSITION METAL COMPLEXES, CATALYSTS COMPOSITION CONTAINING THE SAME, AND PROCESS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND ALPHA-OLEFINS USING THE SAME SK ENERGY CO., LTD. (KR) 2009-07-09 WO 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-20100298512-A1 TRANSITION METAL COMPLEXES, CATALYSTS COMPOSITION CONTAINING THE SAME, AND PROCESS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND ALPHA-OLEFINS USING THE SAME MCM4, ESR1, SEM1 MEN1 478/4885NPC1 1554/4885TSHR 4776/4885

“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.