SCHEMBL7518124

SCHEMBL7518124

Cc1c(-c2ccccc2)sc2ncc(C(=O)C(C)C)c(O)c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.46
BCL2 P10415 2/20 0.39
MCL1 Q07820 2/20 0.39
BCL2L1 Q07817 1/20 0.39
FDPS P14324 2/20 0.37
MEN1 O00255 1/20 0.36
GRM6 O15303 4/20 0.36
ALOX5 P09917 1/20 0.35
LDHA P00338 1/20 0.35
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
NPC1 O15118 1/20 0.34
CASP3 P42574 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
GRM5 P41594 1/20 0.34
XIAP P98170 1/20 0.34

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
SCHEMBL7525431 0.86 GRM6 (0.39) LIMK1MEN1GRM6ALOX5MAPT
SCHEMBL7519571 0.86 LIMK1 (0.49) LIMK1BCL2MCL1BCL2L1FDPS
SCHEMBL7521021 0.84 GRM6 (0.48) LIMK1MEN1GRM6MAPTHPGD
SCHEMBL7545563 0.81 MAPT (0.50) LIMK1MEN1GRM6MAPTHPGD
SCHEMBL8558846 0.81 LIMK1 (0.51) LIMK1BCL2MCL1BCL2L1FDPS
SCHEMBL8151869 0.78 LIMK1 (0.48) LIMK1BCL2MCL1BCL2L1FDPS
SCHEMBL11554443 0.69 CSNK2A2 (0.54) LDHAHPGDNPC1SMN1; SMN2ALDH1A1
SCHEMBL6822486 0.69 GRM6 (0.54) MEN1GRM6MAPTHPGDNPC1
SCHEMBL4504915 0.68 LIMK1 (0.51) LIMK1GRM6MAPTHPGDNPC1
SCHEMBL11580700 0.67 PRNP (0.47) LIMK1ALDH1A1NPSR1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020198384-A1 Thienopyridine derivatives, their intermediates and production thereof MIKI SHOKYO (JP) 2002-12-26 US claimed
US-6437132-B2 INHIBITOR OF GONADOTROPIN RELEASING HORMONE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-08-20 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
JP-11130777-A None JP disclosed
US-20020198384-A1 Thienopyridine derivatives, their intermediates and production thereof MIKI SHOKYO (JP) 2002-12-26 US disclosed
US-6437132-B2 INHIBITOR OF GONADOTROPIN RELEASING HORMONE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-08-20 US disclosed
US-20020019529-A1 Thienopyridine derivatives, their intermediates and production thereof MIKI SHOKYO (JP) 2002-02-14 US disclosed
US-6329388-B2 GONADOTROPIN-RELEASING HORMONE ANTAGONIZING ACTIVITY; USEFUL FOR PREVENTING OR TREATING SEX HORMONE-DEPENDENT DISEASES, E.G., SEX HORMONE-DEPENDENT CANCERS (E.G., PROSTATIC CANCER, UTERINE CANCER, BREAST CANCER, PITUITARY TUMOR) TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-12-11 US disclosed
US-6313301-B1 CYCLIZATION; LUTEINIZING HORMONE RELEASING HORMONE INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-11-06 US disclosed
US-6297255-B1 GONADOTROPIN-RELEASING HORMONE ANTAGONIZING ACTIVITY; PREVENTING OR TREATING SEX HORMONE-DEPENDENT DISEASES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-10-02 US disclosed
CN-1306535-A Thienopyridine compounds, their prodn. and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-08-01 CN disclosed
US-6262267-B1 HAS GONADOTROPIN-RELEASING HORMONE ANTAGONIZING ACTIVITY; USEFUL FOR PREVENTING OR TREATING SEX HORMONE-DEPENDENT DISEASES, E,G., SEX HORMONE-DEPENDENT CANCERS E.G., PROSTATIC CANCER, UTERINE CANCER, BREAST CANCER, PITUITARY TUMOR TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-07-17 US disclosed
US-20010001104-A1 Thienopyridine compounds, their production and use FURUYA SHUICHI (JP) 2001-05-10 US disclosed
EP-1090010-A1 THIENOPYRIDINE COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 2001-04-11 EP disclosed
EP-1004585-A1 THIENOPYRIDINE DERIVATIVES, INTERMEDIATES THEREOF, AND PROCESS FOR PRODUCING THE BOTH Takeda Chemical Industries, Ltd. (JP) 2000-05-31 EP disclosed
WO-2000000493-A1 THIENOPYRIDINE COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-01-06 WO disclosed
JP-H11130777-A THIENOPYRIDINE DERIVATIVE, ITS INTERMEDIATE AND THEIR PRODUCTION TAKEDA CHEM IND LTD 1999-05-18 JP 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 (3 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-20020198384-A1 Thienopyridine derivatives, their intermediates and production thereof GNRHR, KISS1R, CYP19A1 LIMK1 4727/4885BCL2 4519/4885MCL1 4687/4885
US-20010001104-A1 Thienopyridine compounds, their production and use PRLHR, PGR, GNRHR LIMK1 3864/4885BCL2 2856/4885MCL1 3108/4885
US-20020019529-A1 Thienopyridine derivatives, their intermediates and production thereof GNRHR, KISS1R, CYP19A1 LIMK1 4727/4885BCL2 4519/4885MCL1 4687/4885

“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.