SCHEMBL578580

SCHEMBL578580

O=C(O)c1c[c]c(O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
TP53 P04637 1/20 0.52
CA1 P00915 4/20 0.50
CA2 P00918 4/20 0.50
CA12 O43570 3/20 0.50
CA7 P43166 3/20 0.50
CA9 Q16790 3/20 0.50
CA14 Q9ULX7 3/20 0.50
CA4 P22748 2/20 0.50
CA6 P23280 2/20 0.50
CA3 P07451 1/20 0.50
TYR P14679 1/20 0.50
DRD1 P21728 1/20 0.50
CA5A P35218 1/20 0.50
CA5B Q9Y2D0 1/20 0.50
SRD5A2 P31213 4/20 0.46
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL2780243 0.78 TSHR (0.50) TSHRTP53CA1CA2CA12
SCHEMBL1303104 0.78 PARP10 (0.43) TSHRCA1CA2CA12CA9
SCHEMBL2889295 0.78 HSD17B1 (0.46) CA5AGAAMAPTL3MBTL1ALDH1A1
SCHEMBL3147633 0.78 ALDH1A1 (0.58) TSHRTP53SRD5A2MAPTL3MBTL1
SCHEMBL4957915 0.76 TSHR (0.48) TSHRTP53CA1CA2CA12
SCHEMBL185207 0.76 TSHR (0.48) TSHRTP53CA1CA2CA12
SCHEMBL1869090 0.76 ALDH1A1 (0.50) TSHRTP53CA1CA2CA12
SCHEMBL6631569 0.76 TSHR (0.48) TSHRTP53CA1CA2CA12
Terephthalic Acid SCHEMBL5053781 0.71 TSHR (1.00) TSHRTP53CA1CA2CA12
Terephthalic Acid SCHEMBL1655 0.71 TSHR (1.00) TSHRTP53CA1CA2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050176797-A1 2-[5-(5-Carbamimidoyl-1H-heteroaryl)-6-hydroxybiphenyl-3-YL]-succinic acid derivatives as factor viia inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-08-11 US claimed
EP-1408963-A1 2- 5-(5-CARBAMIMIDOYL-1 i H /i -HETEROARYL)-6-HYDROXYBIPHENYL-3-YL]-SUCCINIC ACID DERIVATIVES AS FACTOR VIIA INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2004-04-21 EP claimed
US-20030114457-A1 2- [5- (5-carbamimidoyl-1H-heteroaryl)-6-hydroxybiphenyl-3-yl]-succinic acid derivatives as factor viia inhibitors AXYS PHARMACEUTICALS, INC. (US) 2003-06-19 US claimed
WO-2003006011-A1 2-[5-(5-CARBAMIMIDOYL-1H-HETEROARYL)-6-HYDROXYBIPHENYL-3-YL]-SUCCINIC ACID DERIVATIVES AS FACTOR VIIA INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2003-01-23 WO claimed
EP-3025763-B1 CREAM GEL COMPRISING AT LEAST ONE RETINOID AND BENZOYL PEROXIDE GALDERMA RES & DEV (FR) 2020-06-10 EP disclosed
EP-3355858-B1 NO-RINSE CHEMICAL FOAM CONTAINING BRIMONIDINE, AND USE THEREOF IN THE TREATMENT OF ROSACEA GALDERMA RES & DEV (FR) 2020-03-18 EP disclosed
EP-3355867-B1 NO-RINSE CHEMICAL FOAM COMPRISING IVERMECTIN GALDERMA RES & DEV (FR) 2020-03-18 EP disclosed
EP-3355866-B1 SELF-FOAMING CLEANSING COMPOSITION CONTAINING CLOBETASOL PROPIONATE, AND USE THEREOF IN THE TREATMENT OF PSORIASIS GALDERMA RES & DEV (FR) 2020-03-18 EP disclosed
EP-3355869-B1 RINSE-OFF SELF-FOAMING CLEANSING COMPOSITION CONTAINING IVERMECTIN GALDERMA RES & DEV (FR) 2020-03-18 EP disclosed
EP-3355868-B1 NO-RINSE CHEMICAL FOAM CONTAINING CLOBETASOL PROPIONATE, AND USE THEREOF IN THE TREATMENT OF PSORIASIS GALDERMA RES & DEV (FR) 2020-03-11 EP disclosed
CN-108017577-B The process for catalytic synthesis of 2- pyridone 怀化学院 2019-03-01 CN disclosed
EP-3122325-B1 UNRINSED CHEMICAL FOAMCONTAINING BENZOYL PEROXIDE GALDERMA RES & DEV (FR) 2018-10-31 EP disclosed
EP-0460550-B1 Silver halide photographic material FUJI PHOTO FILM CO LTD (JP) 1997-08-06 EP disclosed
US-5643932-A PREVENTS CELL DAMAGE AFTER ISCHEMIA AND RE-PERFUSION, SUBSTITUTED THIAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 US disclosed
EP-0513387-A1 ACTIVE OXYGEN INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-11-19 EP disclosed
EP-0460550-A1 Silver halide photographic material FUJI PHOTO FILM CO., LTD. (JP) 1991-12-11 EP disclosed
US-4853328-A Reagent for assaying hydrogen peroxide and method of quantitative assay for hydrogen peroxide FUJI PHOTO FILM CO., LTD. (JP) 1989-08-01 US disclosed
EP-0060518-B2 REAGENT FOR ASSAYING HYDROGEN PEROXIDE AND METHOD OF QUANTITATIVE ASSAY FOR HYDROGEN PEROXIDE FUJI PHOTO FILM CO., LTD. (JP) 1988-09-21 EP disclosed
EP-0060518-B1 REAGENT FOR ASSAYING HYDROGEN PEROXIDE AND METHOD OF QUANTITATIVE ASSAY FOR HYDROGEN PEROXIDE FUJI PHOTO FILM CO., LTD. (JP) 1985-07-17 EP disclosed
EP-0060518-A1 Reagent for assaying hydrogen peroxide and method of quantitative assay for hydrogen peroxide FUJI PHOTO FILM CO., LTD. (JP) 1982-09-22 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 (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-20030114457-A1 2- [5- (5-carbamimidoyl-1H-heteroaryl)-6-hydroxybiphenyl-3-yl]-succinic acid derivatives as factor viia inhibitors F7, F9, F5 TSHR 4118/4885TP53 4795/4885CA1 1477/4885
US-20050176797-A1 2-[5-(5-Carbamimidoyl-1H-heteroaryl)-6-hydroxybiphenyl-3-YL]-succinic acid derivatives as factor viia inhibitors F7, F9, F5 TSHR 4118/4885TP53 4795/4885CA1 1477/4885

“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.