Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2034384

C[Si](C)=[Ti+2](NC(=O)C12CC3CC(CC(C3)C1)C2)C1c2ccccc2-c2ccccc21.[Cl-].[Cl-]

nearest known ligand 0.44

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 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
P2RX7 Q99572 6/20 0.42
CNR2 P34972 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
AGTR1 P30556 1/20 0.40
OPRK1 P41145 1/20 0.40
RECQL P46063 1/20 0.40
RAB9A P51151 1/20 0.40
HSD11B1 P28845 1/20 0.39

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 SCHEMBL2038514 0.89 P2RX7 (0.44) MEN1KMT2ANPSR1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL2044611 0.86 MEN1 (0.45) MEN1KMT2ANPSR1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL2042829 0.81 MEN1 (0.45) MEN1KMT2ANPSR1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL2036134 0.81 MEN1 (0.47) MEN1KMT2ANPSR1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL15329122 0.79 MEN1 (0.38) MEN1KMT2ANPSR1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL2038962 0.77 MEN1 (0.46) MEN1KMT2ANPSR1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL2046037 0.75 KMT2A (0.42) MEN1KMT2AALDH1A1LMNAHTT
Hydrochloric Acid SCHEMBL2040601 0.72 CYP2C19 (0.43) NPSR1ALDH1A1LMNAP2RX7HPGD
SCHEMBL2045463 0.67 NPSR1 (0.43) MEN1KMT2ANPSR1LMNAHTT
Hydrochloric Acid SCHEMBL2053671 0.66 GPR3 (0.32) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9701595-B2 Process for producing novel synthetic basestocks EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-07-11 US disclosed
EP-2516598-B1 PROCESS FOR PRODUCING NOVEL SYNTHETIC BASESTOCKS EXXONMOBIL CHEM PATENTS INC (US) 2016-06-29 EP disclosed
US-8530712-B2 Process for producing novel synthetic basestocks EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-09-10 US disclosed
US-20130131410-A1 Process for Producing Novel Synthetic Basestocks EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-05-23 US disclosed
EP-2516598-A2 PROCESS FOR PRODUCING NOVEL SYNTHETIC BASESTOCKS Exxonmobil Chemical Patents Inc. (US) 2012-10-31 EP disclosed
WO-2011079042-A2 PROCESS FOR PRODUCING NOVEL SYNTHETIC BASESTOCKS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-06-30 WO disclosed
US-20110160502-A1 Process for Producing Novel Synthetic Basestocks EXXONMOBIL CHEMICAL PATENTS INC. 2011-06-30 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 (2 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-20130131410-A1 Process for Producing Novel Synthetic Basestocks PYM1, SCO2, SPIN4 MEN1 2463/4885KMT2A 3597/4885NPSR1 2497/4885
US-20110160502-A1 Process for Producing Novel Synthetic Basestocks PYM1, SPIN4, SCO2 MEN1 2848/4885KMT2A 4148/4885NPSR1 2705/4885

“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.