SCHEMBL342460

SCHEMBL342460

COc1cc(COc2[c]c(NS(C)(=O)=O)ccc2)ccc1CCl

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 4/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ABCB1 P08183 3/20 0.33
USP2 O75604 3/20 0.33
CYP1A2 P05177 3/20 0.33
CYP3A4 P08684 3/20 0.33
CYP2D6 P10635 3/20 0.33
CYP2C19 P33261 3/20 0.33
CYP2C9 P11712 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
CLK4 Q9HAZ1 2/20 0.33
GLA P06280 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
F2 P00734 1/20 0.33
F10 P00742 1/20 0.33

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
SCHEMBL3037170 0.76 AR (0.54) CYP19A1MAPTSMN1; SMN2MAPK1
SCHEMBL342680 0.73 ABCB1 (0.42) ABCB1ABCG2
SCHEMBL1923495 0.70 AR (0.43) CYP19A1LMNASMN1; SMN2ALDH1A1F2
SCHEMBL793294 0.69 CYP19A1 (0.31) CYP19A1ABCB1SCN9A
SCHEMBL873803 0.67 TUBB1 (0.40) ABCB1ABCG2
SCHEMBL1829320 0.65 TTR (0.42) CYP19A1MAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL11838721 0.64 CA2 (0.61) MAPTKDM4EALDH1A1MAPK1TSHR
SCHEMBL31435284 0.63 PTGS2 (0.48) CYP19A1MAPTKDM4EALDH1A1MAPK1
SCHEMBL23525664 0.62 HTT (0.38) LMNAMAPTSMN1; SMN2KDM4EUSP2
SCHEMBL1829321 0.62 NPC1 (0.47) CYP3A4MAPK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-RE49934-E1 Inhibitors of cellular metabolic processes SERVIER PHARMACEUTICALS LLC (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
US-11858959-B2 Glycyrrhetinic acid derivatives for use in treating hyperkalemia ARDELYX, INC. (US) 2024-01-02 US disclosed
US-11768319-B2 Glycyrrhetinic acid derivatives for treating hyperkalemia ARDELYX, INC. (US) 2023-09-26 US disclosed
US-20230273354-A1 GLYCYRRHETINIC ACID DERIVATIVES FOR TREATING HYPERKALEMIA ARDELYX, INC. (US) 2023-08-31 US disclosed
EP-4234016-A2 GLYCYRRHETINIC ACID DERIVATIVES FOR USE IN TREATING HYPERKALEMIA Ardelyx, Inc. (US) 2023-08-30 EP disclosed
US-20230265054-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING GENENTECH, INC. (US) 2023-08-24 US disclosed
US-20050186198-A1 Serine protease inhibitors GENENTECH, INC. 2005-08-25 US disclosed
US-6919369-B2 Controlling blood coagulation GENENTECH, INC. (US) 2005-07-19 US disclosed
US-20040242585-A1 Acylsulfamide inhibitors of factor VIIa GENENTECH, INC. 2004-12-02 US disclosed
US-20040235852-A1 Benzofuran inhibitors of factor VIIa GENENTECH, INC. 2004-11-25 US disclosed
US-20040235750-A1 Thiocarbamate inhibitors of alpha-4 integrins GENENTECH, INC. 2004-11-25 US disclosed
US-20040158076-A1 Tyrosine derivatives GENENTECH, INC. 2004-08-12 US disclosed
US-20040110753-A1 Tyrosine derivatives GENENTECH, INC. 2004-06-10 US disclosed
US-20030212071-A1 Serine protease inhibitors GENENTECH, INC. 2003-11-13 US disclosed
US-6472393-B1 Serine protease inhibitors GENENTECH, INC. 2002-10-29 US disclosed
US-6469047-B1 NON-PROTEIN SMALL MOLECULE COMPOUNDS WHICH INHIBIT THE INTERACTION BETWEEN THE ALPHA 4 BETA 7 INTEGRIN AND ITS LIGANDS MADCAM AND/OR VCAM. THESE COMPOUNDS ARE USEFUL FOR TREATMENT OF CHRONIC INFLAMMATORY DISEASES SUCH AS ARTHRITIS GENENTECH, INC. 2002-10-22 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 (13 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-20030212071-A1 Serine protease inhibitors SERPINE1, SPINT2, TFPI CYP19A1 1100/4885LMNA 908/4885MAPT 4012/4885
US-20050186198-A1 Serine protease inhibitors TFPI, SPINT2, SERPINE1 CYP19A1 1209/4885LMNA 831/4885MAPT 3882/4885
US-20240209019-A1 COMPOUNDS AND METHODS FOR TREATING HYPERKALEMIA REN, NHERF1, KCNJ11 CYP19A1 1227/4885LMNA 1098/4885MAPT 3747/4885
US-20040235750-A1 Thiocarbamate inhibitors of alpha-4 integrins ITGB4, ITGA4, ITGB1 CYP19A1 3958/4885LMNA 2603/4885MAPT 2546/4885
US-20230265054-A1 PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING SHH, GLI1, SMO CYP19A1 3751/4885LMNA 3716/4885MAPT 3822/4885
US-20240116872-A1 PYRIDYL INHIBITORS FOR HEDGEHOG SIGNALLING SHH, GLI1, SMO CYP19A1 3863/4885LMNA 3718/4885MAPT 3696/4885
US-11768319-B2 Glycyrrhetinic acid derivatives for treating hyperkalemia HSD11B2, HSD11B1, HSD3B2 CYP19A1 79/4885LMNA 2542/4885MAPT 3787/4885
US-20040235852-A1 Benzofuran inhibitors of factor VIIa TFPI, HABP2, SERPINE1 CYP19A1 120/4885LMNA 1022/4885MAPT 4422/4885
US-20040242585-A1 Acylsulfamide inhibitors of factor VIIa TFPI, TFPI2, HABP2 CYP19A1 441/4885LMNA 1391/4885MAPT 4778/4885
US-20040110753-A1 Tyrosine derivatives VCAM1, ICAM1, ITGB4 CYP19A1 4206/4885LMNA 4385/4885MAPT 2057/4885
US-20230273354-A1 GLYCYRRHETINIC ACID DERIVATIVES FOR TREATING HYPERKALEMIA GRHPR, REN, GRK5 CYP19A1 778/4885LMNA 2166/4885MAPT 3352/4885
US-11858959-B2 Glycyrrhetinic acid derivatives for use in treating hyperkalemia HSD11B2, HSD11B1, NR3C2 CYP19A1 107/4885LMNA 3455/4885MAPT 3972/4885
US-20040158076-A1 Tyrosine derivatives VCAM1, ICAM1, ITGB4 CYP19A1 4206/4885LMNA 4385/4885MAPT 2057/4885

“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.