SCHEMBL6738707

SCHEMBL6738707

COc1cc(C)cc(C(=O)O)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TPMT P51580 2/20 0.64
HCAR1 Q9BXC0 1/20 0.55
CNR2 P34972 1/20 0.53
CA1 P00915 2/20 0.52
CA2 P00918 2/20 0.52
RXRA P19793 2/20 0.52
KDM4E B2RXH2 1/20 0.48
CA12 O43570 1/20 0.48
CA3 P07451 1/20 0.48
PKM P14618 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
CA5A P35218 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
CA5B Q9Y2D0 1/20 0.48
PTGS2 P35354 1/20 0.46
MEN1 O00255 1/20 0.45
POLB P06746 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
SCHEMBL25508535 0.90 TPMT (0.57) TPMTHCAR1CNR2CA1CA2
SCHEMBL39734 0.87 CA1 (0.60) TPMTCA1CA2RXRAKDM4E
3,5-Dimethoxybenzoic Acid SCHEMBL503889 0.87 RXRA (0.64) CA1CA2RXRAKDM4ECA12
3,5-Dimethoxybenzoic Acid SCHEMBL20592058 0.85 RXRA (0.62) CA1CA2RXRAKDM4ECA12
Hydrochloric Acid SCHEMBL19118500 0.85 CA1 (0.58) TPMTCA1CA2RXRAKDM4E
Hydrochloric Acid SCHEMBL3361588 0.85 CA1 (0.58) TPMTCA1CA2RXRAKDM4E
3,5-Dimethoxybenzoic Acid SCHEMBL5668197 0.85 RXRA (0.62) CA1CA2RXRAKDM4ECA12
SCHEMBL12020820 0.83 LMNA (0.48) TPMTKDM4ECA5AMEN1KMT2A
SCHEMBL11914196 0.83 ALDH1A1 (0.46) RXRAKDM4EMEN1POLBKMT2A
3,5-Dimethoxybenzoic Acid SCHEMBL9426765 0.83 RXRA (0.60) CA1CA2RXRAKDM4ECA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119604562-A Hydrophilic oil-repellent polymer 住友化学株式会社 2025-03-11 CN disclosed
CN-119143736-B Diaryl methyl pyrimidine piperazine compound and preparation method, pharmaceutical composition and application thereof 天津匠新致成科技有限公司 2025-03-07 CN disclosed
CN-115335378-B Monoacylglycerol lipase modulators 詹森药业有限公司 2025-03-04 CN disclosed
CN-119143736-A Diaryl methyl pyrimidine piperazine compound and preparation method, pharmaceutical composition and application thereof 天津匠新致成科技有限公司 2024-12-17 CN disclosed
US-20240228484-A1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2024-07-11 US disclosed
US-11891387-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2024-02-06 US disclosed
US-20230159572-A1 ISOPAUCIFLORAL F PHOSPHATE COMPOUND AND PHARMACEUTICAL USE THEREOF FUDAN UNIVERSITY (CN) 2023-05-25 US disclosed
US-11584828-B2 Polyphosphazene polyelectrolytes and uses thereof UNIVERSITY OF MARYLAND, COLLEGE PARK (US) 2023-02-21 US disclosed
EP-4126860-A1 MONOACYLGLYCEROL LIPASE MODULATORS Janssen Pharmaceutica NV (BE) 2023-02-08 EP disclosed
US-20220372030-A1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2022-11-24 US disclosed
US-20080113985-A1 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED 2008-05-15 US disclosed
US-20080019915-A1 including cystic fibrosis transmembrane conductance regulator (\"CFTR\"); N[6-(2-hydroxymethylphenyl-1yl)-5-methylpyrimidine][(4-methoxophenyl-1-yl)cyclopopyl]-amide; genetic disorders; respiratory system disorders, cystic fibrosis, hereditary emphysema and hemochromatosis, coagulation-fibrinolysis VERTEX PHARMACEUTICALS INCORPORATED 2008-01-24 US disclosed
US-6689771-B2 TREATMENT OF RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, PERIODONTITIS, GINGIVITIS, CORNEAL ULCERATION, SOLID TUMOR GROWTH BRISTOL-MYERS SQUIBB PHARMA COMPANY 2004-02-10 US disclosed
US-6610731-B2 Antiinflammatory BRISTOL-MYERS SQUIBB COMPANY 2003-08-26 US disclosed
US-6403632-B1 CYCLIC AMIDE DERIVATIVE BRISTOL MYERS SQUIBB PHARMA CO (US) 2002-06-11 US disclosed
US-6376665-B1 ANTIARTHRITIC AGENTS, ANTIINFLAMMATORY AGENTS BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-04-23 US disclosed
EP-1165500-A1 AMIDE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES,TNF-ALPHA,AND AGGRECANASE Du Pont Pharmaceuticals Company (US) 2002-01-02 EP disclosed
WO-2000059874-A1 NOVEL AMIDE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES, TNF-α, AND AGGRECANASE DU PONT PHARMACEUTICALS COMPANY (US) 2000-10-12 WO disclosed
US-6057336-A ANTIINFLAMMATORY AGENTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-05-02 US disclosed
US-3953595-A Substituted benzoic acid hypolipemic agents PFIZER INC. (US) 1976-04-27 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 (7 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-20240228484-A1 MONOACYLGLYCEROL LIPASE MODULATORS MGLL, LPL, PNLIP TPMT 3400/4885HCAR1 1924/4885CNR2 421/4885
US-20080019915-A1 including cystic fibrosis transmembrane conductance regulator (\"CFTR\"); N[6-(2-hydroxymethylphenyl-1yl)-5-methylpyrimidine][(4-methoxophenyl-1-yl)cyclopopyl]-amide; genetic disorders; respiratory system disorders, cystic fibrosis, hereditary emphysema and hemochromatosis, coagulation-fibrinolysis CFTR, ABCC8, ABCB1 TPMT 311/4885HCAR1 905/4885CNR2 1221/4885
US-11891387-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP TPMT 3400/4885HCAR1 1924/4885CNR2 421/4885
US-11584828-B2 Polyphosphazene polyelectrolytes and uses thereof TLR3, TLR9, TLR1 TPMT 4034/4885HCAR1 298/4885CNR2 1004/4885
US-20080113985-A1 Modulators of ATP-binding cassette transporters CFTR, ABCB1, ABCC2 TPMT 934/4885HCAR1 986/4885CNR2 1601/4885
US-20230159572-A1 ISOPAUCIFLORAL F PHOSPHATE COMPOUND AND PHARMACEUTICAL USE THEREOF INPP5A, INPP5B, ALPP TPMT 2506/4885HCAR1 1184/4885CNR2 4273/4885
US-20220372030-A1 MONOACYLGLYCEROL LIPASE MODULATORS MGLL, LPL, PNLIP TPMT 3400/4885HCAR1 1924/4885CNR2 421/4885

“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.