SCHEMBL265577

SCHEMBL265577

C[C@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.61
TBXAS1 P24557 2/20 0.60
HPGD P15428 1/20 0.59
CYP3A4 P08684 2/20 0.58
TSHR P16473 1/20 0.58
ALPI P09923 1/20 0.57
PKM P14618 1/20 0.57
PTGS1 P23219 1/20 0.57
XIAP P98170 1/20 0.57
SLC7A5 Q01650 1/20 0.57
NPC1 O15118 2/20 0.57
RAB9A P51151 2/20 0.57
MAPK1 P28482 1/20 0.56
HSD17B10 Q99714 1/20 0.54
CPA1 P15085 2/20 0.53
CPA3 P15088 2/20 0.53
FOLH1 Q04609 1/20 0.53
CPB1 P15086 1/20 0.53
CPB2 Q96IY4 1/20 0.53
MEN1 O00255 1/20 0.53

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
SCHEMBL265135 1.00 CYP1A2 (0.61) CYP1A2TBXAS1HPGDCYP3A4TSHR
SCHEMBL65930 1.00 CYP1A2 (0.61) CYP1A2TBXAS1HPGDCYP3A4TSHR
SCHEMBL27514358 0.98 CYP1A2 (0.59) CYP1A2TBXAS1HPGDCYP3A4TSHR
Water SCHEMBL10936876 0.98 CYP1A2 (0.59) CYP1A2TBXAS1HPGDCYP3A4TSHR
SCHEMBL11237591 0.91 TBXAS1 (0.59) CYP1A2TBXAS1HPGDCYP3A4TSHR
Tert-Butylamine SCHEMBL1883188 0.90 ALPI (0.53) CYP1A2TBXAS1HPGDCYP3A4TSHR
Tert-Butylamine SCHEMBL1880992 0.90 ALPI (0.53) CYP1A2TBXAS1HPGDCYP3A4TSHR
Tert-Butylamine SCHEMBL1880991 0.90 ALPI (0.53) CYP1A2TBXAS1HPGDCYP3A4TSHR
SCHEMBL7507834 0.88 MME (0.63) CPA1
SCHEMBL16948243 0.88 MME (0.63) CPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101912382-B 2-phenylpropionic acid derivatives and pharmaceutical compositions containing them DOMPE SPA 2012-11-21 CN claimed
CN-101912382-A 2-phenylpropionic acid derivatives and pharmaceutical compositions containing them DOMPE SPA 2010-12-15 CN claimed
CN-1934077-B 2-phenylpropionic acid derivatives and pharmaceutical compositions containing them DOMPE PHA R MA SPA RES & MFG 2010-09-29 CN claimed
CN-122059780-A Asymmetric synthesis method of alpha-chiral ester compound 内蒙古大学 2026-05-19 CN disclosed
CN-115043721-B Preparation method of alpha-substituted chiral carboxylic acid compound 山东师范大学 2024-03-26 CN disclosed
US-20240024410-A1 THREE-DIMENTIONAL SURFACE FOR PROTEIN AND SMALL MOLECULE MICROARRAYS THE JOHNS HOPKINS UNIVERSITY 2024-01-25 US disclosed
US-11708391-B2 Rapaglutins, novel inhibitors of GLUT and use thereof THE JOHNS HOPKINS UNIVERSITY (US) 2023-07-25 US disclosed
US-RE49351-E1 Cytoprotective agent BIOGEN MA INC. (US) 2023-01-03 US disclosed
WO-2022224035-A2 ANTI-GM1 ANTIBODY BINDING COMPOUNDS POLYNEURON PHARMACEUTICALS AG (CH) 2022-10-27 WO disclosed
CN-115043721-A Preparation method of alpha-substituted chiral carboxylic acid compound 山东师范大学 2022-09-13 CN disclosed
US-20210322381-A1 DRUG FOR TREATMENT OR PREVENTION OF BLOOD CEREBRAL HEMORRHAGE, AND METHOD FOR TREATING OR PREVENTING CEREBRAL HEMORRHAGE USING THE DRUG CORXEL PHARMACEUTICALS HONG KONG LIMITED (CN) 2021-10-21 US disclosed
US-5302528-A Hydrolysis of a racemic ester mixture to the stereospecific alpha-aryl or -aryloxyalkanoic acid Ministero Dell `Universita` e Della Ricerca Scientifica e Technologica (IT) 1994-04-12 US disclosed
EP-0229614-B1 PROCESS FOR THE SELECTIVE REGENERATION OF MEDIATORS AND CATALYST THEREFOR BASF Aktiengesellschaft (DE) 1992-11-11 EP disclosed
EP-0510712-A2 Process for the separation of the optical isomers of alpha-substituted carboxylic acids MINISTERO DELL' UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECNOLOGICA (IT) 1992-10-28 EP disclosed
CN-1055181-A SELECTIVE ADENOSINE RECEPTOR AGENTS MERRELL DOW PHARMA (US) 1991-10-09 CN disclosed
EP-0449175-A2 Selective adenosine receptor agents MERRELL PHARMACEUTICALS INC. (US) 1991-10-02 EP disclosed
US-5047534-A Xanthine derivatives; hyupotensive agents, cardiotonic agents MERRELL DOW PHARMACEUTICALS INC. (US) 1991-09-10 US disclosed
US-4837189-A Surfactant modified metal catalysts BASF AKTIENGESELLSCHAFT (DE) 1989-06-06 US disclosed
US-4749670-A Selective regeneration of mediators in the presence of a catalyst and surfactant BASF AKTIENGESELLSCHAFT (DE) 1988-06-07 US disclosed
EP-0229614-A2 Process for the selective regeneration of mediators and catalyst therefor BASF Aktiengesellschaft (DE) 1987-07-22 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 (3 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-20210322381-A1 DRUG FOR TREATMENT OR PREVENTION OF BLOOD CEREBRAL HEMORRHAGE, AND METHOD FOR TREATING OR PREVENTING CEREBRAL HEMORRHAGE USING THE DRUG PROC, FABP7, TIMP3 CYP1A2 1427/4885TBXAS1 1150/4885HPGD 197/4885
US-11708391-B2 Rapaglutins, novel inhibitors of GLUT and use thereof SLC2A1, SLC2A4, SLC2A2 CYP1A2 3807/4885TBXAS1 1014/4885HPGD 3458/4885
US-20240024410-A1 THREE-DIMENTIONAL SURFACE FOR PROTEIN AND SMALL MOLECULE MICROARRAYS MRPS23, CD2BP2, MRPL21 CYP1A2 4720/4885TBXAS1 2417/4885HPGD 2326/4885

“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.