SCHEMBL6395177

SCHEMBL6395177

O=C1OC(=O)c2c(-c3ccccc3)cc(S(=O)(=O)O)c3cccc1c23

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYMS P04818 5/20 0.40
▸ CHEK1 O14757 1/20 0.40
▸ RCE1 Q9Y256 1/20 0.40
▸ PGAM1 P18669 1/20 0.40
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ RECQL P46063 1/20 0.36
▸ CHAT P28329 1/20 0.36
▸ SNCA P37840 1/20 0.36
▸ PRKDC P78527 1/20 0.36
▸ CES1 P23141 1/20 0.35
▸ GPR84 Q9NQS5 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ WEE1 P30291 1/20 0.35
▸ HDAC4 P56524 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ MAPK1 P28482 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
SCHEMBL6394120 0.84 CHEK1 (0.36) TYMSCHEK1RCE1PGAM1MEN1
SCHEMBL22005486 0.81 PGAM1 (0.36) TYMSPGAM1MEN1KMT2ARECQL
SCHEMBL6390921 0.81 TYMS (0.39) TYMSPGAM1KMT2ASNCACES1
SCHEMBL6388568 0.79 TYMS (0.39) TYMSPGAM1MEN1KMT2ACES1
SCHEMBL6390741 0.79 TYMS (0.38) TYMSPGAM1CHATSNCACES1
SCHEMBL6394517 0.78 TYMS (0.37) TYMSPGAM1CES1KDM4EHPGD
SCHEMBL6395017 0.76 MAPKAPK2 (0.38) TYMSPGAM1GPR84KDM4EHPGD
SCHEMBL30203973 0.75 TYMS (0.54) TYMSMEN1KMT2ACHATSNCA
SCHEMBL1710169 0.75 TYMS (0.54) TYMSMEN1KMT2ACHATSNCA
SCHEMBL6389534 0.75 ELANE (0.38) TYMSPGAM1AURKAAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050040373-A1 Dopant and conductive polymer material therewith MITSUI CHEMICALS, INC. (JP) 2005-02-24 — — US disclosed
US-6814888-B2 FOR PRODUCING SOLID ELECTROLYTIC CAPACITOR MITSUI CHEMICALS, INC. (JP) 2004-11-09 — — US disclosed
US-20030142462-A1 Dopant agent and electroconductive polymer material comprising the same MITSUI CHEMICALS, INC. (JP) 2003-07-31 — — 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 (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-20030142462-A1 Dopant agent and electroconductive polymer material comprising the same RPS6, H1-10, H1-0 TYMS 4742/4885CHEK1 1404/4885RCE1 4754/4885

“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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