SCHEMBL6605520

SCHEMBL6605520

O=C1CCSc2c(O)cc(Cl)cc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VHL P40337 1/20 0.51
ELOC Q15369 1/20 0.51
ELOB Q15370 1/20 0.51
HSP90AA1 P07900 1/20 0.38
CA2 P00918 2/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 3/20 0.36
HTT P42858 1/20 0.34
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
PRKCI P41743 1/20 0.32
DAO P14920 1/20 0.32
TSHR P16473 2/20 0.31
HSD17B10 Q99714 2/20 0.31
HPGD P15428 1/20 0.31
GAA P10253 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL30543398 0.82 VHL (0.54) VHLELOCELOBCA2MEN1
SCHEMBL67587 0.82 VHL (0.54) VHLELOCELOBCA2MEN1
SCHEMBL13890187 0.79 VHL (0.51) VHLELOCELOBCA2MEN1
SCHEMBL6605669 0.76 KDM4E (0.54) VHLELOCELOBHSP90AA1CA2
SCHEMBL6605262 0.72 VHL (0.44) VHLELOCELOBCA2MEN1
SCHEMBL23861146 0.69 VHL (0.37) VHLELOCELOBMEN1KMT2A
SCHEMBL8296391 0.69 VHL (0.44) VHLELOCELOBCA2MEN1
SCHEMBL9607632 0.69 VHL (0.37) VHLELOCELOBMEN1KMT2A
SCHEMBL28387239 0.69 VHL (0.44) VHLELOCELOBCA2MEN1
SCHEMBL69544 0.68 VHL (1.00) VHLELOCELOBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1196696-C New thiochromane derivatives and use as thrombin inhibitors ASTRAZENECA AG (SE) 2005-04-13 CN disclosed
US-6716834-B2 ANTICOAGULANTS. ASTRAZENECA AB (SE) 2004-04-06 US disclosed
EP-1283837-B1 NEW THIOCHROMANE DERIVATIVES AND THEIR USE AS THROMBIN INHIBITORS ASTRAZENECA AB (SE) 2004-02-25 EP disclosed
US-20030220317-A1 Thiochromane derivatives and their use as thrombin inhibitors ASTRAZENECA AB (SE) 2003-11-27 US disclosed
CN-1441799-A New thiochromane derivatives and use as thrombin inhibitors ASTRAZENECA AG (SE) 2003-09-10 CN disclosed
EP-1283837-A1 NEW THIOCHROMANE DERIVATIVES AND THEIR USE AS THROMBIN INHIBITORS AstraZeneca AB (SE) 2003-02-19 EP disclosed
WO-2001087879-A1 NEW THIOCHROMANE DERIVATIVES AND THEIR USE AS THROMBIN INHIBITORS ASTRAZENECA AB (SE) 2001-11-22 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 (1 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-20030220317-A1 Thiochromane derivatives and their use as thrombin inhibitors SERPINC1, F2, TFPI VHL 1345/4885ELOC 4483/4885ELOB 4130/4885

“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.