SCHEMBL6544690

SCHEMBL6544690

CC(C)C(=O)c1cn(Cc2c(F)cccc2F)c2sc(-c3ccc(N)cc3)c(CN(C)Cc3ccccc3)c2c1=O

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 20/20 0.81
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68

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
Oxalic Acid SCHEMBL7524227 0.99 GNRHR (0.80) GNRHRMEN1KMT2A
Malonic Acid SCHEMBL7525788 0.97 GNRHR (0.79) GNRHRMEN1KMT2A
Succinic Acid SCHEMBL7525336 0.97 GNRHR (0.77) GNRHRMEN1KMT2A
Fumaric Acid SCHEMBL7516281 0.96 GNRHR (0.76) GNRHRMEN1KMT2A
Fumaric Acid SCHEMBL7516278 0.96 GNRHR (0.76) GNRHRMEN1KMT2A
SCHEMBL7523063 0.96 GNRHR (0.78) GNRHRMEN1KMT2A
SCHEMBL7011239 0.94 GNRHR (0.84) GNRHRMEN1KMT2A
Malic Acid SCHEMBL7529453 0.94 GNRHR (0.72) GNRHRMEN1KMT2A
SCHEMBL8160999 0.93 GNRHR (0.82) GNRHRMEN1KMT2A
Hydrochloric Acid SCHEMBL7503209 0.92 GNRHR (0.81) GNRHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0756599-B1 BICYCLIC THIOPHENE DERIVATIVES AND USE AS GONADOTROPIN RELEASING HORMONE ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-11-26 EP claimed
US-20020198384-A1 Thienopyridine derivatives, their intermediates and production thereof MIKI SHOKYO (JP) 2002-12-26 US claimed
US-20020019529-A1 Thienopyridine derivatives, their intermediates and production thereof MIKI SHOKYO (JP) 2002-02-14 US claimed
EP-1004585-A1 THIENOPYRIDINE DERIVATIVES, INTERMEDIATES THEREOF, AND PROCESS FOR PRODUCING THE BOTH Takeda Chemical Industries, Ltd. (JP) 2000-05-31 EP claimed
US-20040116522-A1 Medicinal solutions TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-06-17 US disclosed
EP-1393747-A1 PREVENTIVES/REMEDIES FOR ALZHEIMER'S DISEASE Takeda Chemical Industries, Ltd. (JP) 2004-03-03 EP disclosed
US-20040034039-A1 Solid preparations TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-02-19 US disclosed
US-20040023987-A1 Sustained release compositions TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-02-05 US disclosed
EP-1374855-A1 MEDICINAL SOLUTIONS Takeda Chemical Industries, Ltd. (JP) 2004-01-02 EP disclosed
EP-0756599-B1 BICYCLIC THIOPHENE DERIVATIVES AND USE AS GONADOTROPIN RELEASING HORMONE ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-11-26 EP disclosed
US-20030134863-A1 Preventives/remedies for alzheimer's disease TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2003-07-17 US disclosed
EP-1319409-A1 SOLID PREPARATIONS Takeda Chemical Industries, Ltd. (JP) 2003-06-18 EP disclosed
US-20010001104-A1 Thienopyridine compounds, their production and use FURUYA SHUICHI (JP) 2001-05-10 US disclosed
US-6187788-B1 THIENO(2,3-B)(DIHYDRO)PYRIDINE DERIVATIVES; GONADOTROPIN-RELEASING HORMONE ANTAGONISTS; ANTICARCINOGENIC AGENTS; SEXUAL AND UROGENITAL DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-02-13 US disclosed
US-6180792-B1 DRUGS, ANTISECRETORY AGENTS AND HORMONE INHIBITORS FOR LH-RH TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-01-30 US disclosed
EP-1004585-A1 THIENOPYRIDINE DERIVATIVES, INTERMEDIATES THEREOF, AND PROCESS FOR PRODUCING THE BOTH Takeda Chemical Industries, Ltd. (JP) 2000-05-31 EP disclosed
US-6048863-A SEXUAL DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-04-11 US disclosed
US-5817819-A GONADOTROPIN-RELEASING HORMONE ANTAGONIST TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-10-06 US disclosed
EP-0756599-A1 BICYCLIC THIOPHENE DERIVATIVES AND USE AS GONADOTROPIN RELEASING HORMONE ANTAGONISTS Takeda Chemical Industries, Ltd. (JP) 1997-02-05 EP disclosed
WO-1995028405-A1 BICYCLIC THIOPHENE DERIVATIVES AND USE AS GONADOTROPIN RELEASING HORMONE ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-10-26 WO 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 (6 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-20030134863-A1 Preventives/remedies for alzheimer's disease ACHE, GNRHR, PSEN1 GNRHR 2/4885MEN1 477/4885KMT2A 1190/4885
US-20040023987-A1 Sustained release compositions NGLY1, GHSR, GHRHR GNRHR 46/4885MEN1 710/4885KMT2A 4627/4885
US-20020198384-A1 Thienopyridine derivatives, their intermediates and production thereof GNRHR, KISS1R, CYP19A1 GNRHR 1/4885MEN1 1739/4885KMT2A 1900/4885
US-20010001104-A1 Thienopyridine compounds, their production and use PRLHR, PGR, GNRHR GNRHR 3/4885MEN1 517/4885KMT2A 446/4885
US-20020019529-A1 Thienopyridine derivatives, their intermediates and production thereof GNRHR, KISS1R, CYP19A1 GNRHR 1/4885MEN1 1739/4885KMT2A 1900/4885
US-20040034039-A1 Solid preparations GYS1, GYS2, SI GNRHR 3501/4885MEN1 3398/4885KMT2A 4091/4885

“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.