SCHEMBL145084

SCHEMBL145084

COc1ccc(Cc2ccc(OC)cc2OC)c(OC)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.68
MAPT P10636 2/20 0.61
TSHR P16473 2/20 0.61
GAA P10253 1/20 0.61
MAPK1 P28482 1/20 0.61
HTT P42858 1/20 0.61
CA2 P00918 2/20 0.60
CA12 O43570 1/20 0.60
CA1 P00915 1/20 0.60
CA7 P43166 1/20 0.60
CA9 Q16790 1/20 0.60
CA14 Q9ULX7 1/20 0.60
CNR2 P34972 1/20 0.54
ALDH1A1 P00352 3/20 0.52
CYP3A4 P08684 1/20 0.52
CYP1A1 P04798 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP1B1 Q16678 1/20 0.52
IDO1 P14902 2/20 0.50
ADRA1A P35348 1/20 0.50

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
SCHEMBL5612174 0.88 APLNR (0.59) APLNRMAPTTSHRGAAMAPK1
SCHEMBL15081223 0.86 APLNR (0.53) APLNRMAPTTSHRGAAMAPK1
SCHEMBL14777867 0.85 APLNR (0.61) APLNRMAPTTSHRGAAMAPK1
SCHEMBL3300286 0.85 LTA4H (0.58) APLNRMAPTTSHRALDH1A1
SCHEMBL11477519 0.84 APLNR (0.66) APLNRMAPTCA2CA12CA1
SCHEMBL31172821 0.84 APLNR (0.66) APLNRMAPTCA2CA12CA1
SCHEMBL805138 0.84 APLNR (0.66) APLNRMAPTCA2CA12CA1
SCHEMBL2099082 0.84 APLNR (0.51) APLNRMAPTTSHRGAAMAPK1
SCHEMBL29485595 0.84 APLNR (0.76) APLNRTSHRCA2CA12CA1
SCHEMBL680457 0.84 APLNR (0.76) APLNRTSHRCA2CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8492384-B2 Imidazolylalkylcarbonyl derivatives as calcium channel modulators and preparation method thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-07-23 US claimed
US-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-12-31 US claimed
EP-4397366-A2 GLYCYRRHETINIC ACID DERIVATIVES FOR TREATING HYPERKALEMIA Ardelyx, Inc. (US) 2024-07-10 EP disclosed
US-20240209019-A1 COMPOUNDS AND METHODS FOR TREATING HYPERKALEMIA ARDELYX, INC. (US) 2024-06-27 US disclosed
US-12017989-B2 Controlled release pharmaceutical formulations UNITED THERAPEUTICS CORPORATION (US) 2024-06-25 US disclosed
US-12012466-B2 Peptide macrocycles against Acinetobacter baumannii HOFFMANN-LA ROCHE INC. (US) 2024-06-18 US disclosed
US-11963994-B2 Inhibitors of IAP GENENTECH, INC. (US) 2024-04-23 US disclosed
US-20240116872-A1 PYRIDYL INHIBITORS FOR HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2024-04-11 US disclosed
EP-3661945-B1 GLYCYRRHETINIC ACID DERIVATIVES FOR TREATING HYPERKALEMIA ARDELYX INC (US) 2024-04-03 EP disclosed
EP-4320132-A1 OXAZEPINE COMPOUNDS AND USES THEREOF IN THE TREATMENT OF CANCER Genentech, Inc. (US) 2024-02-14 EP disclosed
US-11883406-B2 Method for producing alginic acid-folic acid conjugate, alginic acid-folic acid conjugate produced thereby and pharmaceutical composition containing the same SEOUL NATIONAL UNIVERSITY R&DB FOUNDATION (KR) 2024-01-30 US disclosed
US-4795815-A BACTERICIDES, MICROBIOCIDES ELI LILLY AND COMPANY (US) 1989-01-03 US disclosed
US-4767871-A Pyrazolidinium ylides ELI LILLY AND COMPANY (US) 1988-08-30 US disclosed
US-4734504-A 1-alkylated diazolidinones ELI LILLY AND COMPANY (US) 1988-03-29 US disclosed
US-4734505-A 1-(alkylated)-2-(acylated)diazolidinones ELI LILLY AND COMPANY (US) 1988-03-29 US disclosed
US-4716232-A 1-(vinyl phosphonate adduct) pyrazolidinones ELI LILLY AND COMPANY (US) 1987-12-29 US disclosed
EP-0203722-A1 Bicyclic pyrazolidinones ELI LILLY AND COMPANY (US) 1986-12-03 EP disclosed
EP-0203723-A1 2,3-(dihydro)bicyclic pyrazolidinones ELI LILLY AND COMPANY (US) 1986-12-03 EP disclosed
EP-0202794-A1 7-Substituted-2,3-(Dihydro) bicyclic pyrazolidinones ELI LILLY AND COMPANY (US) 1986-11-26 EP disclosed
EP-0202046-A1 7-Substituted bicyclic pyrazolidinones ELI LILLY AND COMPANY (US) 1986-11-20 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 (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-12017989-B2 Controlled release pharmaceutical formulations PTGIR, PTGIS, PTGER1 APLNR 2188/4885MAPT 3120/4885TSHR 1740/4885
US-20240209019-A1 COMPOUNDS AND METHODS FOR TREATING HYPERKALEMIA REN, NHERF1, KCNJ11 APLNR 2108/4885MAPT 3747/4885TSHR 667/4885
US-12012466-B2 Peptide macrocycles against Acinetobacter baumannii VIP, ARG1, CX3CR1 APLNR 52/4885MAPT 4627/4885TSHR 267/4885
US-20240116872-A1 PYRIDYL INHIBITORS FOR HEDGEHOG SIGNALLING SHH, GLI1, SMO APLNR 85/4885MAPT 3696/4885TSHR 453/4885
US-11963994-B2 Inhibitors of IAP BIRC5, XIAP, BIRC3 APLNR 930/4885MAPT 2549/4885TSHR 2662/4885
US-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF CACNA1B, CACNA1C, ORAI1 APLNR 1563/4885MAPT 2493/4885TSHR 3065/4885
US-11883406-B2 Method for producing alginic acid-folic acid conjugate, alginic acid-folic acid conjugate produced thereby and pharmaceutical composition containing the same FOLR1, FOLR2, MTHFD1 APLNR 907/4885MAPT 3627/4885TSHR 4055/4885

“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.