SCHEMBL12046499

SCHEMBL12046499

CCc1cc(-c2[nH]nc(S)c2-c2ccc3[nH]c(C)c(C)c3c2)c(O)cc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.44
▸ HSP90AA1 P07900 7/20 0.44
▸ MEN1 O00255 5/20 0.44
▸ KMT2A Q03164 5/20 0.44
▸ HSP90AB1 P08238 4/20 0.44
▸ TDP1 Q9NUW8 3/20 0.44
▸ MET P08581 1/20 0.44
▸ PIM1 P11309 1/20 0.44
▸ LTK P29376 1/20 0.44
▸ KDM4E B2RXH2 8/20 0.42
▸ ALDH1A1 P00352 6/20 0.42
▸ HSD17B10 Q99714 3/20 0.42
▸ GFER P55789 2/20 0.42
▸ ALOX15 P16050 2/20 0.42
▸ HPGD P15428 7/20 0.39
▸ TSHR P16473 2/20 0.39
▸ GAA P10253 5/20 0.39
▸ LMNA P02545 6/20 0.37
▸ HTT P42858 3/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37

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
SCHEMBL12046493 0.81 GAA (0.43) MAPTHSP90AA1MEN1KMT2AHSP90AB1
SCHEMBL1343801 0.80 HSP90AA1 (0.43) MAPTHSP90AA1MEN1KMT2AHSP90AB1
SCHEMBL1148730 0.79 HSP90AA1 (0.44) MAPTHSP90AA1MEN1KMT2AHSP90AB1
SCHEMBL1149462 0.79 HSP90AA1 (0.39) MAPTHSP90AA1MEN1KMT2AHSP90AB1
SCHEMBL12046415 0.76 HSP90AA1 (0.41) MAPTHSP90AA1MEN1KMT2AHSP90AB1
SCHEMBL1343850 0.74 HSP90AA1 (0.41) MAPTHSP90AA1MEN1KMT2AHSP90AB1
SCHEMBL1148572 0.73 GAA (0.43) MAPTHSP90AA1MEN1KMT2AHSP90AB1
SCHEMBL12553626 0.73 ALOX5 (0.43) MAPTHSP90AA1MEN1KMT2AHSP90AB1
SCHEMBL14425301 0.73 HSP90AA1 (0.41) MAPTHSP90AA1MEN1KMT2AHSP90AB1
SCHEMBL1148627 0.73 KMT2A (0.45) MAPTHSP90AA1MEN1KMT2AHSP90AB1

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9108933-B2 Method for treating proliferative disorders associated with mutations in c-Met SYNTA PHARMACEUTICALS CORP. (US) 2015-08-18 — — US disclosed
US-9108933-B2 Method for treating proliferative disorders associated with mutations in c-Met SYNTA PHARMACEUTICALS CORP. (US) 2015-08-18 — — US disclosed
US-9101614-B2 Method for treating non-Hodgkin's lymphoma SYNTA PHARMACEUTICALS CORP. (US) 2015-08-11 — — US disclosed
US-9101614-B2 Method for treating non-Hodgkin's lymphoma SYNTA PHARMACEUTICALS CORP. (US) 2015-08-11 — — US disclosed
US-20150094349-A1 Method for Treating Proliferative Disorders Associated with Protooncogene Products SYNTA PHARMACEUTICALS CORP (US) 2015-04-02 — — US disclosed
US-20150094349-A1 Method for Treating Proliferative Disorders Associated with Protooncogene Products SYNTA PHARMACEUTICALS CORP (US) 2015-04-02 — — US disclosed
US-8969396-B2 Method for treating a B-raf associated cancer with an Hsp90 inhibitor SYNTA PHARMACEUTICALS CORP. (US) 2015-03-03 — — US disclosed
US-8969396-B2 Method for treating a B-raf associated cancer with an Hsp90 inhibitor SYNTA PHARMACEUTICALS CORP. (US) 2015-03-03 — — US disclosed
US-8921407-B2 Pyrazole compounds that modulate HSP90 activity SYNTA PHARMACEUTICALS CORP. (US) 2014-12-30 — — US disclosed
US-8921407-B2 Pyrazole compounds that modulate HSP90 activity SYNTA PHARMACEUTICALS CORP. (US) 2014-12-30 — — US disclosed
US-20100069442-A1 PYRAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY SYNTA PHARMACEUTICALS CORP. 2010-03-18 — — US disclosed
US-7608635-B2 heat shock protein 90 inhibitors; antiproliferative agents; angiogenesis inhibitors SYNTA PHARMACEUTICALS CORP. (US) 2009-10-27 — — US disclosed
US-7608635-B2 heat shock protein 90 inhibitors; antiproliferative agents; angiogenesis inhibitors SYNTA PHARMACEUTICALS CORP. (US) 2009-10-27 — — US disclosed
US-20080004276-A1 Method for treating non-hodgkin's lymphoma LSI FINANCING LLC, AS ADMINISTRATIVE AGENT 2008-01-03 — — US disclosed
US-20080004276-A1 Method for treating non-hodgkin's lymphoma LSI FINANCING LLC, AS ADMINISTRATIVE AGENT 2008-01-03 — — US disclosed
US-20080004266-A1 Method for treating proliferative disorders associated with protooncogene products LSI FINANCING LLC, AS ADMINISTRATIVE AGENT 2008-01-03 — — US disclosed
US-20080004266-A1 Method for treating proliferative disorders associated with protooncogene products LSI FINANCING LLC, AS ADMINISTRATIVE AGENT 2008-01-03 — — US disclosed
US-20070191445-A1 heat shock protein 90 inhibitors; antiproliferative agents; angiogenesis inhibitors LSI FINANCING LLC, AS ADMINISTRATIVE AGENT 2007-08-16 — — US disclosed
US-20070191445-A1 heat shock protein 90 inhibitors; antiproliferative agents; angiogenesis inhibitors LSI FINANCING LLC, AS ADMINISTRATIVE AGENT 2007-08-16 — — US disclosed
WO-2007021966-A1 PYRAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY SYNTA PHARMACEUTICALS CORP. (US) 2007-02-22 — — 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 (5 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-20070191445-A1 heat shock protein 90 inhibitors; antiproliferative agents; angiogenesis inhibitors HSP90AB1, HSP90AA1, HSP90AB2P MAPT 3018/4885HSP90AA1 2/4885MEN1 4130/4885
US-20100069442-A1 PYRAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY HSP90AB1, HSP90AA1, HSP90B1 MAPT 3253/4885HSP90AA1 2/4885MEN1 3879/4885
US-20150094349-A1 Method for Treating Proliferative Disorders Associated with Protooncogene Products HSP90AB1, HSP90AB2P, HSP90AA1 MAPT 2568/4885HSP90AA1 3/4885MEN1 4527/4885
US-20080004276-A1 Method for treating non-hodgkin's lymphoma HSP90AB1, HSP90AB2P, HSP90B1 MAPT 3136/4885HSP90AA1 4/4885MEN1 4169/4885
US-20080004266-A1 Method for treating proliferative disorders associated with protooncogene products HSP90AB1, HSP90AB2P, HSP90AA1 MAPT 2568/4885HSP90AA1 3/4885MEN1 4527/4885

“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.

Send feedback