SCHEMBL1449566

SCHEMBL1449566

CC(N)c1ccccc1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
ALOX15 P16050 1/20 0.52
TDP1 Q9NUW8 2/20 0.50
GAA P10253 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
KDM4E B2RXH2 4/20 0.45
HPGD P15428 3/20 0.45
CA12 O43570 3/20 0.45
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
CA4 P22748 3/20 0.45
CA7 P43166 3/20 0.45
CA9 Q16790 3/20 0.45
NAPRT Q6XQN6 3/20 0.45
HMGB1 P09429 2/20 0.45
CA6 P23280 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CA14 Q9ULX7 1/20 0.45

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 SCHEMBL6093184 0.98 ALDH1A1 (0.50) ALDH1A1ALOX15TDP1GAAKMT2A
Hydrazine SCHEMBL27571459 0.85 ALDH1A1 (0.54) ALDH1A1ALOX15TDP1GAAKMT2A
SCHEMBL134091 0.85 ALDH1A1 (0.59) ALDH1A1ALOX15TDP1GAAKMT2A
SCHEMBL254364 0.85 ALDH1A1 (0.59) ALDH1A1ALOX15TDP1GAAKMT2A
SCHEMBL29657201 0.85 ALDH1A1 (0.59) ALDH1A1ALOX15TDP1GAAKMT2A
Benzene SCHEMBL28132022 0.85 ALDH1A1 (0.59) ALDH1A1ALOX15TDP1GAAKMT2A
Hydrogen Peroxide SCHEMBL9514730 0.85 ALDH1A1 (0.59) ALDH1A1ALOX15TDP1GAAKMT2A
SCHEMBL10726252 0.83 IRAK4 (0.43) ALDH1A1KDM4ESMN1; SMN2ADRA2AADRA2C
SCHEMBL28814411 0.83 IRAK4 (0.43) ALDH1A1KDM4ESMN1; SMN2ADRA2AADRA2C
SCHEMBL731619 0.83 IRAK4 (0.52) ALDH1A1GAAMAPTKDM4EHPGD

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 82 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8299225-B2 Amidite for synthesizing modified nucleic acid and method for synthesizing modified nucleic acid FUJITSU LIMITED (JP) 2012-10-30 US claimed
US-20110124705-A1 PRODRUGS OF ALPHA-2-DELTA LIGANDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2011-05-26 US claimed
US-20090062521-A1 AMIDITE FOR SYNTHESIZING MODIFIED NUCLEIC ACID AND METHOD FOR SYNTHESIZING MODIFIED NUCLEIC ACID FUJITSU LIMITED (JP) 2009-03-05 US claimed
US-20080167459-A1 Amidite for nucleic acid synthesis and nucleic acid synthesizing method FUJITSU LIMITED (JP) 2008-07-10 US claimed
US-7053122-B2 Therapeutic use of aryl amino acid derivatives PFIZER INC (US) 2006-05-30 US claimed
EP-1658059-A1 A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF OBESITY OR TO FACILITATE OR PROMOTE WEIGHT LOSS Pfizer Products Inc. (US) 2006-05-24 EP claimed
EP-1658098-A1 PHARMACEUTICAL COMPOSITION COMPRISING AN ALPHA2DELTA LIGAND AND AN OPIOID RECEPTOR ANTAGONIST FOR THE PREVENTION AND TREATMENT OF ADDICTION IN A MAMMAL Pfizer Products Inc. (US) 2006-05-24 EP claimed
EP-1658058-A1 A PHARMACEUTICAL COMPOSITION FOR THE PREVENTION AND TREATMENT OF ADDICTION IN A MAMMAL Pfizer Products Inc. (US) 2006-05-24 EP claimed
EP-1528919-A2 THERAPEUTIC USE OF ARYL AMINO ACID DERIVATIVES Pfizer Limited (GB) 2005-05-11 EP claimed
WO-2005018622-A1 A PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF OBESITY OR TO FACILITATE OR PROMOTE WEIGHT LOSS PFIZER PRODUCTS INC. (US) 2005-03-03 WO claimed
WO-2005018621-A1 A PHARMACEUTICAL COMPOSITION FOR THE PREVENTION AND TREATMENT OF ADDICTION IN A MAMMAL PFIZER PRODUCTS INC. (US) 2005-03-03 WO claimed
WO-2005018670-A1 PHARMACEUTICAL COMPOSITION COMPRISING AN ALPHA2DELTA LIGAND AND AN OPIOID RECEPTOR ANTAGONIST FOR THE PREVENTION AND TREATMENT OF ADDICTION IN A MAMMAL PFIZER PRODUCTS INC. (US) 2005-03-03 WO claimed
US-20050043407-A1 Pharmaceutical composition for the prevention and treatment of addiction in a mammal PFIZER INC 2005-02-24 US claimed
US-20050043406-A1 Pharmaceutical composition for the treatment of obesity or to facilitate or promote weight loss PFIZER INC 2005-02-24 US claimed
US-20050043345-A1 Pharmaceutical composition for the prevention and treatment of addiction in a mammal PFIZER INC 2005-02-24 US claimed
US-20040138197-A1 Therapeutic use of aryl amino acid derivatives MAW GRAHAM NIGEL (GB) 2004-07-15 US claimed
WO-2004014357-A2 THERAPEUTIC USE OF ARYL AMINO ACID DERIVATIVES PFIZER LIMITED (GB) 2004-02-19 WO claimed
EP-0254009-B1 A PROCESS FOR PURIFYING DINITROANILINE HERBICIDES AGAN CHEMICAL MANUFACTURERS LTD. (IL) 1991-04-17 EP claimed
EP-3478725-B1 MODIFIED CARBOHYDRATES, COMPOSITIONS COMPRISING THE SAME, AND METHODS OF MAKING AND USING THE SAME UNIV WAKE FOREST HEALTH SCIENCES (US) 2022-08-10 EP disclosed
US-5378728-A Benzoic acid derivatives as antidiabetic agents SANDOZ LTD. (CH) 1995-01-03 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 (4 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-20080167459-A1 Amidite for nucleic acid synthesis and nucleic acid synthesizing method GABBR2, RNGTT, BCAT2 ALDH1A1 1516/4885ALOX15 2974/4885TDP1 764/4885
US-20040138197-A1 Therapeutic use of aryl amino acid derivatives CNR1, HCRTR1, HTR6 ALDH1A1 776/4885ALOX15 1746/4885TDP1 399/4885
US-20090062521-A1 AMIDITE FOR SYNTHESIZING MODIFIED NUCLEIC ACID AND METHOD FOR SYNTHESIZING MODIFIED NUCLEIC ACID NSUN2, RNMT, ADAR ALDH1A1 2737/4885ALOX15 2412/4885TDP1 387/4885
US-20110124705-A1 PRODRUGS OF ALPHA-2-DELTA LIGANDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF CHRND, CHRNE, CHRNG ALDH1A1 1298/4885ALOX15 2819/4885TDP1 2147/4885

“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.