SCHEMBL7575487

SCHEMBL7575487

CC(C)c1ccc(C(=O)O)cc1N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 3/20 0.56
TDP1 Q9NUW8 4/20 0.54
GRM1 Q13255 2/20 0.54
MEN1 O00255 1/20 0.54
CYP1A2 P05177 1/20 0.54
KMT2A Q03164 1/20 0.54
KDM4E B2RXH2 8/20 0.49
GAA P10253 7/20 0.49
MAPT P10636 5/20 0.49
ALDH1A1 P00352 4/20 0.49
THRB P10828 3/20 0.49
HPGD P15428 3/20 0.49
GFER P55789 2/20 0.49
HTT P42858 1/20 0.49
PLEC Q15149 1/20 0.49
CDC25B P30305 1/20 0.46
HSD17B10 Q99714 4/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
NPC1 O15118 1/20 0.45
SMN1; SMN2 Q16637 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
SCHEMBL29559674 0.85 PRKCI (0.53) ACE2TDP1GRM1MEN1CYP1A2
SCHEMBL22897740 0.85 PRKCI (0.53) ACE2TDP1GRM1MEN1CYP1A2
SCHEMBL13903051 0.85 ACE2 (0.51) ACE2TDP1GRM1MEN1CYP1A2
Hydrochloric Acid SCHEMBL7965073 0.83 ACE2 (0.50) ACE2TDP1GRM1MEN1CYP1A2
SCHEMBL13816269 0.82 ACE2 (0.61) ACE2TDP1GRM1MEN1CYP1A2
SCHEMBL7398459 0.80 GRM1 (0.68) ACE2TDP1GRM1MEN1CYP1A2
SCHEMBL13958157 0.80 KDM4E (0.62) KDM4EGAAMAPTALDH1A1HPGD
SCHEMBL8381715 0.80 GRM1 (0.68) ACE2TDP1GRM1MEN1CYP1A2
SCHEMBL6557670 0.80 GRM1 (0.46) ACE2TDP1GRM1MEN1CYP1A2
SCHEMBL18666525 0.80 ALDH1A1 (0.52) ACE2TDP1GRM1MEN1CYP1A2

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
EP-2953927-B1 SUBSTITUTED BENZAMIDES WITH ACTIVITY TOWARDS EP4 RECEPTORS DRACONIS PHARMA S L (ES) 2016-11-16 EP disclosed
US-20150376129-A1 SUBSTITUTED BENZAMIDES WITH ACTIVITY TOWARDS EP4 RECEPTORS DRACONIS PHARMA, S.L. (ES) 2015-12-31 US disclosed
EP-2953927-A1 SUBSTITUTED BENZAMIDES WITH ACTIVITY TOWARDS EP4 RECEPTORS Draconis Pharma, S.L. (ES) 2015-12-16 EP disclosed
WO-2014122267-A1 SUBSTITUTED BENZAMIDES WITH ACTIVITY TOWARDS EP4 RECEPTORS DRACONIS PHARMA, S.L. (ES) 2014-08-14 WO disclosed
EP-2765128-A1 Substituted benzamides with activity towards EP4 receptors Almirall, S.A. (ES) 2014-08-13 EP disclosed
US-20090082368-A1 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PAINCEPTOR PHARMA CORPORATION (CA) 2009-03-26 US disclosed
US-20090082368-A1 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PAINCEPTOR PHARMA CORPORATION (CA) 2009-03-26 US disclosed
EP-2017263-A1 HETEROARYLAMIDE LOWER CARBOXYLIC ACID DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2009-01-21 EP disclosed
EP-0685470-B1 Benzene derivatives and pharmaceutical composition KUREHA CHEMICAL IND CO LTD (JP) 2002-09-11 EP disclosed
US-5747541-A Substituted benzoylguanidines, a process for their preparation, their use as medicament of diagnostic agent, and medicament comprising them HOECHST AKTIENGESELLSCHAFT (DE) 1998-05-05 US disclosed
CN-1153773-A substituted benzoyl guanidine its preparation, application as medicine or diagnostic reagent and medicine containing the said compound HOECHST AG (DE) 1997-07-09 CN disclosed
EP-0765868-A1 Substituted bezoyl guanidines, process for their preparation, their use as antiarrhythmics or diagnostic agent as well as pharmaceuticals containing them HOECHST AKTIENGESELLSCHAFT (DE) 1997-04-02 EP disclosed
EP-0685470-A2 Benzene derivatives and pharmaceutical composition Kureha Chemical Industry Co., Ltd. (JP) 1995-12-06 EP 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-20150376129-A1 SUBSTITUTED BENZAMIDES WITH ACTIVITY TOWARDS EP4 RECEPTORS PTGER4, PTGER1, PTGER2 ACE2 1376/4885TDP1 4719/4885GRM1 701/4885
US-20090082368-A1 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY NGF, BDNF, NTRK2 ACE2 2009/4885TDP1 2055/4885GRM1 143/4885

“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.