SCHEMBL5926041

SCHEMBL5926041

Cc1c[c]c2ccsc2n1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 1/20 0.32
LTK P29376 1/20 0.32
TYRO3 Q06418 1/20 0.32
NTRK2 Q16620 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
MAPK1 P28482 1/20 0.30
HSD17B10 Q99714 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL5926130 0.68 ADORA2A (0.31)
SCHEMBL30060196 0.66 CCR1 (0.44) NTRK1LTKTYRO3NTRK2CLK4
SCHEMBL422300 0.66 CCR1 (0.44) NTRK1LTKTYRO3NTRK2CLK4
SCHEMBL71510 0.64
SCHEMBL2010154 0.63
SCHEMBL21295836 0.61 KDM4E (0.33)
SCHEMBL14438012 0.61 L3MBTL1 (0.34) NTRK1LTKTYRO3NTRK2CLK4
SCHEMBL14309739 0.61 CYP1A2 (0.44) NTRK1NTRK2CLK4MAPK1HSD17B10
SCHEMBL7954685 0.60 CYP1A2 (0.48) L3MBTL1
SCHEMBL315820 0.60 TP53 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060142336-A1 N-sulfonylpiperidines as metalloproteinase inhibitors (tace) ASTRAZENECA AB (SE) 2006-06-29 US disclosed
US-20060063818-A1 Hydantoin derivatives and deren verwendung als tace inhibitoren ASTRAZENECA AB (SE) 2006-03-23 US disclosed
US-20060019994-A1 I-sulphonlyl piperidine derivatives ASTRAZENECA AB (SE) 2006-01-26 US disclosed
US-20050256176-A1 Sulphonamide derivatives and their use as tace inhibitors ASTAZENECA AB (SE) 2005-11-17 US disclosed
EP-1539706-A1 1-SULPHONYL PIPERIDINE DERIVATIVES AstraZeneca AB (SE) 2005-06-15 EP disclosed
EP-1539740-A1 SULPHONAMIDE DERIVATIVES AND THEIR USE AS TACE INHIBITORS AstraZeneca AB (SE) 2005-06-15 EP disclosed
EP-1534281-A1 N-SULFONYLPIPERIDINES AS METALLOPROTEINASE INHIBITORS (TACE) Astrazeneca AB (SE) 2005-06-01 EP disclosed
WO-2004024698-A1 1-SULPHONYL PIPERIDINE DERIVATIVES ASTRAZENECA AB (SE) 2004-03-25 WO disclosed
WO-2004024715-A1 SULPHONAMIDE DERIVATIVES AND THEIR USE AS TACE INHIBITORS ASTRAZENECA AB (SE) 2004-03-25 WO disclosed
WO-2004006925-A1 N-SULFONYLPIPERIDINES AS METALLOPROTEINASE INHIBITORS (TACE) ASTRAZENECA AB (SE) 2004-01-22 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 (4 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-20050256176-A1 Sulphonamide derivatives and their use as tace inhibitors ADAM10, ADAM17, TNF NTRK1 2872/4885LTK 2938/4885TYRO3 3177/4885
US-20060019994-A1 I-sulphonlyl piperidine derivatives MMP1, TPSAB1, CASP1 NTRK1 4486/4885LTK 1783/4885TYRO3 3407/4885
US-20060063818-A1 Hydantoin derivatives and deren verwendung als tace inhibitoren HPN, ADAM17, ADAM33 NTRK1 3194/4885LTK 3759/4885TYRO3 4461/4885
US-20060142336-A1 N-sulfonylpiperidines as metalloproteinase inhibitors (tace) ADAM10, ADAM9, CTRL NTRK1 4084/4885LTK 3763/4885TYRO3 3365/4885

“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.