SCHEMBL3058667

SCHEMBL3058667

Cn1c(C(=O)Cl)cc2cc(F)ccc21

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.73
▸ ALDH1A1 P00352 2/20 0.73
▸ HPGD P15428 2/20 0.73
▸ HSD17B10 Q99714 2/20 0.73
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ IDO1 P14902 1/20 0.52
▸ LMNA P02545 4/20 0.51
▸ TP53 P04637 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ MCL1 Q07820 2/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ RXFP1 Q9HBX9 2/20 0.44
▸ CCR2 P41597 1/20 0.43
▸ HDAC3 O15379 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ CLK1 P49759 1/20 0.42
▸ DYRK1A Q13627 1/20 0.42
▸ DYRK1B Q9Y463 1/20 0.42

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
SCHEMBL2732524 0.85 KDM4E (0.76) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL986506 0.85 KDM4E (1.00) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL4744999 0.83 KDM4E (0.73) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL20559065 0.81 L3MBTL1 (0.70) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL2277162 0.81 KDM4E (0.69) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL3534182 0.80 MCL1 (0.73) KDM4EALDH1A1HPGDHSD17B10MCL1
SCHEMBL19332382 0.79 KDM4E (0.46) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL4502502 0.78 KDM4E (0.75) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL2322980 0.77 MCL1 (0.71) MEN1KMT2AIDO1MCL1
SCHEMBL2281043 0.77 ALDH1A1 (0.64) KDM4EALDH1A1HPGDHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541406-B2 Thiadiazole derivatives for the treatment of neurodegenerative diseases NV REMYND (BE) 2013-09-24 — — US disclosed
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2010-10-14 — — US disclosed
US-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-09-17 — — US disclosed
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-02-26 — — 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 (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-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 KDM4E 4164/4885ALDH1A1 1930/4885HPGD 1746/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 KDM4E 4164/4885ALDH1A1 1930/4885HPGD 1746/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 KDM4E 4164/4885ALDH1A1 1930/4885HPGD 1746/4885

“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.

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