Acetic Acid

Acetic Acid

SCHEMBL1446325

CC(=O)O.Clc1cc(Cl)cc(Nc2ccccc2)c1

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Acetic 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
MAPT P10636 5/20 0.59
RAB9A P51151 3/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
NPSR1 Q6W5P4 1/20 0.59
POLB P06746 1/20 0.53
ALDH1A1 P00352 3/20 0.49
GAA P10253 2/20 0.49
NPC1 O15118 2/20 0.49
HSP90AA1 P07900 1/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
HSD17B10 Q99714 2/20 0.46
EGFR P00533 1/20 0.46
MAPK13 O15264 2/20 0.46
MAPK12 P53778 2/20 0.46
MAPK11 Q15759 2/20 0.46
MAPK14 Q16539 2/20 0.46

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
SCHEMBL3170386 0.88 HSD17B10 (0.60) MAPTRAB9AMEN1KMT2ANPSR1
Acetic Acid SCHEMBL6243148 0.87 MAPT (0.61) MAPTRAB9AMEN1KMT2ANPSR1
Diphenylamine SCHEMBL6904395 0.83 MAPT (0.71) MAPTRAB9AMEN1KMT2APOLB
Diphenylamine SCHEMBL28553827 0.83 MAPT (0.71) MAPTRAB9AMEN1KMT2APOLB
Diphenylamine SCHEMBL374606 0.79 MAPT (0.71) MAPTRAB9AMEN1KMT2APOLB
Diphenylamine SCHEMBL1626446 0.75 MAPT (0.61) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL7152596 0.75 RAB9A (0.65) MAPTRAB9AMEN1KMT2ANPSR1
Diphenylamine SCHEMBL8610102 0.74 MAPT (0.65) MAPTRAB9AMEN1KMT2APOLB
Diphenylamine SCHEMBL21145296 0.74 MAPT (0.65) MAPTRAB9AMEN1KMT2APOLB
SCHEMBL12218114 0.74 MEN1 (1.00) MAPTRAB9AMEN1KMT2ANPSR1

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
US-20120309835-A1 METHODS, ASSAYS AND COMPOSITIONS FOR TREATING RETINOL-RELATED DISEASES REVISION THERAPEUTICS, INC. (US) 2012-12-06 US disclosed
US-20120288568-A1 METHODS AND COMPOSITIONS FOR TREATING OPHTHALMIC CONDITIONS VIA SERUM RETINOL, SERUM RETINOL BINDING PROTEIN (RBP), AND/OR SERUM RETINOL-RBP MODULATION REVISION THERAPEUTICS, INC. (US) 2012-11-15 US disclosed
US-20120202885-A1 METHODS, ASSAYS AND COMPOSITIONS FOR TREATING RETINOL-RELATED DISEASES REVISION THERAPEUTICS, INC. (US) 2012-08-09 US disclosed
EP-2289500-A1 Retinol binding protein and transthyretin modulators for treating hypertosis, Alzheimer's disease or idiopathic intracranial hypertension ReVision Therapeutics, Inc. (US) 2011-03-02 EP disclosed
EP-1904043-A4 METHODS AND COMPOSITIONS FOR TREATING OPHTHALMIC CONDITIONS VIA SERUM RETINOL, SERUM RETINOL BINDING PROTEIN (RBP), AND/OR SERUM RETINOL-RBP MODULATION SIRION THERAPEUTICS INC (US) 2008-09-17 EP disclosed
EP-1930046-A1 Retinol binding protein and transthyretin modulators for treating diabetes Sirion Therapeutics, Inc. (US) 2008-06-11 EP disclosed
EP-1827407-A4 METHODS, ASSAYS AND COMPOSITIONS FOR TREATING RETINOL-RELATED DISEASES SIRION THERAPEUTICS INC (US) 2008-05-21 EP disclosed
EP-1904043-A2 METHODS AND COMPOSITIONS FOR TREATING OPHTHALMIC CONDITIONS VIA SERUM RETINOL, SERUM RETINOL BINDING PROTEIN (RBP), AND/OR SERUM RETINOL-RBP MODULATION Sirion Therapeutics, Inc. (US) 2008-04-02 EP disclosed
EP-1827407-A2 METHODS, ASSAYS AND COMPOSITIONS FOR TREATING RETINOL-RELATED DISEASES Sirion Therapeutics, Inc. (US) 2007-09-05 EP disclosed
US-20070015827-A1 Methods and compositions for treating ophthalmic conditions via serum retinol, serum retinol binding protein (RBP), and/or serum retinol-RBP modulation SYTERA, INC. (US) 2007-01-18 US disclosed
WO-2007008821-A2 METHODS AND COMPOSITIONS FOR TREATING OPHTHALMIC CONDITIONS VIA SERUM RETINOL, SERUM RETINOL BINDING PROTEIN (RBP), AND/OR SERUM RETINOL-RBP MODULATION SIRION THERAPEUTICS, INC. (US) 2007-01-18 WO disclosed
US-20060135460-A1 Methods, assays and compositions for treating retinol-related diseases SYTERA, INC. (US) 2006-06-22 US disclosed
WO-2006063128-A2 METHODS, ASSAYS AND COMPOSITIONS FOR TREATING RETINOL-RELATED DISEASES SIRION THERAPEUTICS, INC. (US) 2006-06-15 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 (5 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-20120288568-A1 METHODS AND COMPOSITIONS FOR TREATING OPHTHALMIC CONDITIONS VIA SERUM RETINOL, SERUM RETINOL BINDING PROTEIN (RBP), AND/OR SERUM RETINOL-RBP MODULATION RBP1, RBP4, ALDH1A2 MAPT 1143/4885RAB9A 1958/4885MEN1 4677/4885
US-20120309835-A1 METHODS, ASSAYS AND COMPOSITIONS FOR TREATING RETINOL-RELATED DISEASES RBP1, RBP4, TTR MAPT 223/4885RAB9A 2415/4885MEN1 1658/4885
US-20060135460-A1 Methods, assays and compositions for treating retinol-related diseases RBP1, RBP4, TTR MAPT 223/4885RAB9A 2415/4885MEN1 1658/4885
US-20070015827-A1 Methods and compositions for treating ophthalmic conditions via serum retinol, serum retinol binding protein (RBP), and/or serum retinol-RBP modulation RBP1, RBP4, ALDH1A2 MAPT 1143/4885RAB9A 1958/4885MEN1 4677/4885
US-20120202885-A1 METHODS, ASSAYS AND COMPOSITIONS FOR TREATING RETINOL-RELATED DISEASES RBP1, RBP4, TTR MAPT 223/4885RAB9A 2415/4885MEN1 1658/4885

“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.