SCHEMBL145083

SCHEMBL145083

COc1ccc([CH]c2ccc(OC)cc2OC)c(OC)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 15/20 0.76
CYP1A1 P04798 14/20 0.76
CYP1B1 Q16678 14/20 0.76
ALDH1A1 P00352 3/20 0.70
NFE2L2 Q16236 2/20 0.66
CYP3A4 P08684 2/20 0.61
CYP2C19 P33261 2/20 0.61
MEN1 O00255 2/20 0.61
MAPT P10636 2/20 0.61
KMT2A Q03164 2/20 0.61
CYP2E1 P05181 1/20 0.61
CYP2C8 P10632 1/20 0.61
CYP2D6 P10635 1/20 0.61
CYP2A6 P11509 1/20 0.61
CYP2C9 P11712 1/20 0.61
CYP4B1 P13584 1/20 0.61
CYP2B6 P20813 1/20 0.61
CYP3A5 P20815 1/20 0.61
CYP2A7 P20853 1/20 0.61
CYP3A7 P24462 1/20 0.61

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
SCHEMBL25706432 0.86 CYP1A2 (1.00) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL3300283 0.85 CYP1A2 (0.73) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL1547597 0.84 CYP1A2 (0.73) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL2099078 0.84 CYP1A2 (0.77) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL5324697 0.83 CYP1A2 (0.65) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL9545111 0.83 CYP1A2 (0.70) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL30411244 0.83 CYP1A2 (0.70) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL96291 0.83 ALDH1A1 (1.00) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL7003172 0.83 CYP1A2 (0.70) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2
SCHEMBL11108516 0.83 CYP1A2 (0.70) CYP1A2CYP1A1CYP1B1ALDH1A1NFE2L2

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 689 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 CYP1A2 333/4885CYP1A1 1126/4885CYP1B1 1041/4885
US-20240209019-A1 COMPOUNDS AND METHODS FOR TREATING HYPERKALEMIA REN, NHERF1, KCNJ11 CYP1A2 1230/4885CYP1A1 1839/4885CYP1B1 2389/4885
US-12012466-B2 Peptide macrocycles against Acinetobacter baumannii VIP, ARG1, CX3CR1 CYP1A2 2774/4885CYP1A1 1382/4885CYP1B1 1694/4885
US-20240116872-A1 PYRIDYL INHIBITORS FOR HEDGEHOG SIGNALLING SHH, GLI1, SMO CYP1A2 4261/4885CYP1A1 3818/4885CYP1B1 2613/4885
US-11963994-B2 Inhibitors of IAP BIRC5, XIAP, BIRC3 CYP1A2 4785/4885CYP1A1 3962/4885CYP1B1 4528/4885
US-20090325979-A1 NOVEL IMIDAZOLYLALKYLCARBONYL DERIVATIVES AS CALCIUM CHANNEL MODULATORS AND PREPARATION METHOD THEREOF CACNA1B, CACNA1C, ORAI1 CYP1A2 3803/4885CYP1A1 3819/4885CYP1B1 3593/4885
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 CYP1A2 2768/4885CYP1A1 3146/4885CYP1B1 3005/4885

“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.