4-Guanidino-Benzoic Acid

4-Guanidino-Benzoic Acid

SCHEMBL7563601

CS(=O)(=O)O.N=C(N)Nc1ccc(C(=O)O)cc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of 4-Guanidino-Benzoic 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
F2 known ✓ P00734 2/20 0.49
CA2 P00918 6/20 0.50
CA1 P00915 4/20 0.50
PRSS1 P07477 2/20 0.49
PRSS2 P07478 2/20 0.49
PRSS3 P35030 2/20 0.49
TMPRSS6 Q8IU80 1/20 0.49
ST14 Q9Y5Y6 1/20 0.49
EPHX2 P34913 1/20 0.46
NR1H4 Q96RI1 1/20 0.46
ALDH1A1 P00352 1/20 0.46
F11 P03951 2/20 0.46
CA12 O43570 5/20 0.46
CA9 Q16790 5/20 0.46
KMT2A Q03164 2/20 0.45
MITF O75030 1/20 0.45
MEN1 O00255 1/20 0.45
FFAR1 O14842 1/20 0.44
STAT3 P40763 1/20 0.43
CA3 P07451 1/20 0.43

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
4-Guanidino-Benzoic Acid SCHEMBL19205978 0.93 CA2 (0.50) CA2CA1F2PRSS1PRSS2
4-Guanidino-Benzoic Acid SCHEMBL211005 0.91 F2 (0.57) CA2CA1F2PRSS1PRSS2
4-Guanidino-Benzoic Acid SCHEMBL10674543 0.89 F2 (0.55) CA2CA1F2PRSS1PRSS2
4-Guanidino-Benzoic Acid SCHEMBL22127093 0.89 F2 (0.55) CA2CA1F2PRSS1PRSS2
4-Guanidino-Benzoic Acid SCHEMBL11123754 0.89 F2 (0.55) CA2CA1F2PRSS1PRSS2
4-Guanidino-Benzoic Acid SCHEMBL273175 0.89 F2 (0.55) CA2CA1F2PRSS1PRSS2
4-Guanidino-Benzoic Acid SCHEMBL28796971 0.87 F2 (0.53) CA2CA1F2PRSS1PRSS2
4-Guanidino-Benzoic Acid SCHEMBL22127091 0.87 F2 (0.58) CA2CA1F2PRSS1PRSS2
SCHEMBL9717016 0.83 MEN1 (0.56) ALDH1A1KMT2AMEN1
4-Guanidino-Benzoic Acid SCHEMBL9303333 0.81 F2 (0.61) F2PRSS1PRSS2PRSS3TMPRSS6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022164150-A1 NAFAMOSTAT MESYLATE AND METHOD FOR PRODUCING INTERMEDIATE THEREOF (주)국전약품 2022-08-04 WO claimed
CN-119053164-A Perovskite solar cell capable of reducing interface defects of electronic layer and preparation method 西南石油大学 2024-11-29 CN disclosed
WO-2022164150-A1 NAFAMOSTAT MESYLATE AND METHOD FOR PRODUCING INTERMEDIATE THEREOF (주)국전약품 2022-08-04 WO disclosed
US-9656972-B2 Compounds for treatment of cystic fibrosis THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2017-05-23 US disclosed
US-20160159754-A1 COMPOUNDS FOR TREATMENT OF CYSTIC FIBROSIS THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH 2016-06-09 US disclosed
EP-3016944-A1 COMPOUNDS FOR TREATMENT OF CYSTIC FIBROSIS The California Institute for Biomedical Research (US) 2016-05-11 EP disclosed
CN-105518000-A Compounds for treatment of cystic fibrosis CALIFORNIA INST BIOMEDICAL RES 2016-04-20 CN disclosed
WO-2015003083-A1 COMPOUNDS FOR TREATMENT OF CYSTIC FIBROSIS THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2015-01-08 WO disclosed
EP-0802179-B1 SUBSTITUTED AMIDINONAPHTHYL ESTER DERIVATIVES TORII PHARMACEUTICAL CO LTD (JP) 2002-08-21 EP disclosed
CN-1300303-A Enzyme inhibitors PROCTER & GAMBLE (US) 2001-06-20 CN disclosed
US-6211186-B1 POLYOXYALKYLENE GLYCOL MODIFIED WITH N-HETEROCYCLE DERIVATIVE WITH AMIDINE OR GUANIDINE GROUP; DIAPER RASH, OBESITY, ACNE, PERIODONTAL DISEASE, CONTRACEPTIVES; PROTEASE AND LIPASE INHIBITORS THE PROCTER & GAMBLE COMPANY 2001-04-03 US disclosed
EP-1062264-A2 ENZYME INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2000-12-27 EP disclosed
US-6066673-A COMPOUND CONTAINING A POLYOXYALKYLENE GLYCOL ENCAPPED WITH A GROUP CONTAINING AN AROMATIC CARBOCYCLIC RING HAVING GUANIDINE OR AMIDINE GROUP; USE IN PERSONAL CARE APPLICATIONS ON AN ABSORBENT CARRIER; DIAPER RASH WIPES THE PROCTER & GAMBLE COMPANY (US) 2000-05-23 US disclosed
WO-1999046316-A2 ENZYME INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 1999-09-16 WO disclosed
US-5885990-A FIBRINOLYSIS PROMOTING ACTION; THROMBOLYSIS ACTION TORII PHARMACEUTICAL CO., LTD. (JP) 1999-03-23 US disclosed
EP-0802179-A1 SUBSTITUTED AMIDINONAPHTHYL ESTER DERIVATIVES TORII PHARMACEUTICAL CO., LTD. (JP) 1997-10-22 EP disclosed
US-5075335-A Enzyme inhibitors EISAI CO., LTD. (JP) 1991-12-24 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-20160159754-A1 COMPOUNDS FOR TREATMENT OF CYSTIC FIBROSIS CFTR, ELANE, OTC F2 1700/4885CA2 2965/4885CA1 4834/4885

“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.