SCHEMBL7984802

SCHEMBL7984802

CNC(=O)c1ccccc1S(C)(=O)=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.67
POLB P06746 1/20 0.58
GAA P10253 1/20 0.53
PLK1 P53350 1/20 0.50
JAK2 O60674 8/20 0.49
JAK1 P23458 8/20 0.49
TYK2 P29597 8/20 0.49
KCNH2 Q12809 5/20 0.49
KIT P10721 3/20 0.49
LMNA P02545 1/20 0.49
PABPC1 P11940 1/20 0.49
EIF4H Q15056 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
STAT3 P40763 1/20 0.47
PDE4D Q08499 1/20 0.47
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
KMT2A Q03164 2/20 0.45

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
SCHEMBL30843217 1.00 BCAT2 (0.67) BCAT2POLBGAAPLK1JAK2
SCHEMBL4805233 0.85 POLB (0.58) BCAT2POLBGAAPLK1LMNA
SCHEMBL19071638 0.84 POLB (0.54) BCAT2POLBGAAPLK1JAK2
SCHEMBL11435059 0.83 POLB (0.56) BCAT2POLBGAAPLK1LMNA
SCHEMBL1127863 0.83 CA1 (0.71) BCAT2POLBGAALMNAPABPC1
SCHEMBL10435055 0.83 CA2 (0.71) BCAT2POLBGAAPLK1CA1
SCHEMBL31650197 0.83 POLB (0.56) BCAT2POLBGAAPLK1LMNA
SCHEMBL11435058 0.81 POLB (0.55) BCAT2POLBGAAPLK1LMNA
SCHEMBL7974285 0.81 POLB (0.55) BCAT2POLBGAAPLK1JAK2
SCHEMBL2451515 0.80 BCAT2 (0.61) BCAT2POLBGAALMNAPABPC1

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-9056862-B2 Thioxothiazolidine derivative having Ras function inhibitory effect NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2015-06-16 US disclosed
US-9056862-B2 Thioxothiazolidine derivative having Ras function inhibitory effect NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2015-06-16 US disclosed
US-20140194412-A1 THIOXOTHIAZOLIDINE DERIVATIVE HAVING RAS FUNCTION INHIBITORY EFFECT KNC LABORATORIES CO., LTD. (JP) 2014-07-10 US disclosed
US-20140194412-A1 THIOXOTHIAZOLIDINE DERIVATIVE HAVING RAS FUNCTION INHIBITORY EFFECT KNC LABORATORIES CO., LTD. (JP) 2014-07-10 US disclosed
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 WO disclosed
EP-1835340-A1 Positive resist composition and pattern formation method using the positive resist composition FUJIFILM Corporation (JP) 2007-09-19 EP 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 (2 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-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF HSD11B1, HSD11B2, HSD3B1 BCAT2 2486/4885POLB 2414/4885GAA 1904/4885
US-20140194412-A1 THIOXOTHIAZOLIDINE DERIVATIVE HAVING RAS FUNCTION INHIBITORY EFFECT KRAS, NRAS, RASSF5 BCAT2 2088/4885POLB 4545/4885GAA 3516/4885

“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.