SCHEMBL532804

SCHEMBL532804

Cc1ccc(OC(=O)c2c(F)c(F)c(F)c(F)c2F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
ALDH1A1 P00352 3/20 0.51
KMT2A Q03164 5/20 0.47
MAPT P10636 3/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
PTK2B Q14289 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
PRSS1 P07477 1/20 0.45
ACR P10323 1/20 0.45
MEN1 O00255 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
GAA P10253 2/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41

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
SCHEMBL2832840 0.86 LMNA (0.47) LMNAALDH1A1KMT2AMAPTNPC1
SCHEMBL342679 0.86 LMNA (0.64) LMNAALDH1A1KMT2AMAPTNPC1
SCHEMBL2833915 0.84 KMT2A (0.49) ALDH1A1KMT2AMAPTNPC1RAB9A
SCHEMBL2356535 0.84 ELANE (0.44) ALDH1A1KMT2AMAPTRAB9AMEN1
SCHEMBL12442879 0.84 ELANE (0.42) LMNAALDH1A1KMT2AMAPTNPC1
SCHEMBL13864952 0.83 KMT2A (0.44) LMNAALDH1A1KMT2AMAPTNPC1
SCHEMBL2838178 0.81 ALDH1A1 (0.57) LMNAALDH1A1KMT2AMAPTNPC1
SCHEMBL2220747 0.80 MAPT (0.46) ALDH1A1KMT2AMAPTNPC1RAB9A
SCHEMBL2835375 0.80 KMT2A (0.51) LMNAALDH1A1KMT2AMAPTNPC1
SCHEMBL2835534 0.80 HPGD (0.50) LMNAALDH1A1MAPTRAB9APTK2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1511713-B8 COMPOUNDS THAT ABROGATE DNA-DAMAGE-INDUCED CELL CYCLE G2 CHECKPOINT AND/OR AUGMENT THE ANTI-CANCER ACTIVITY OF DNA-DAMAGING TREATMENTS CANBAS CO LTD (JP) 2012-02-08 EP claimed
EP-1511713-B1 COMPOUNDS THAT ABROGATE DNA-DAMAGE-INDUCED CELL CYCLE G2 CHECKPOINT AND/OR AUGMENT THE ANTI-CANCER ACTIVITY OF DNA-DAMAGING TREATMENTS CANBAS CO LTD (JP) 2011-08-17 EP claimed
US-20080227827-A1 COMPOUNDS THAT ABROGATE DNA DAMAGE INDUCED CELL CYCLE G2 CHECKPOINT AND/OR AUGMENT ANTI-CANCER ACTIVITY OF DNA-DAMAGING TREATMENTS CANBAS CO., LTD. (JP) 2008-09-18 US claimed
JP-2007501608-A 2007-02-01 JP claimed
US-20060122269-A1 Compounds that abrogate DNA damage induced cell cycle G2 checkpoint and/or augment anti-cancer activity of DNA-damaging treatments CANBAS CO., LTD. (JP) 2006-06-08 US claimed
EP-1664340-A1 SENSITIVITY TEST TO PREDICT EFFICACY OF ANTI-CANCER THERAPIES Canbas Co., Ltd. (JP) 2006-06-07 EP claimed
US-7030111-B2 Compounds that abrogate DNA-damage-induced cell cycle G2 checkpoint and/or augment the anti-cancer activity of DNA damaging treatments CANBAS CO., LTD. (JP) 2006-04-18 US claimed
US-20060014157-A1 Sensitivity test to predict efficacy of anti-cancer therapies CANBAS CO., LTD. (JP) 2006-01-19 US claimed
EP-1511713-A2 COMPOUNDS THAT ABROGATE DNA-DAMAGE-INDUCED CELL CYCLE G2 CHECKPOINT AND/OR AUGMENT THE ANTI-CANCER ACTIVITY OF DNA-DAMAGING TREATMENTS Canbas Co. Ltd. (JP) 2005-03-09 EP claimed
WO-2005014856-A1 SENSITIVITY TEST TO PREDICT EFFICACY OF ANTI-CANCER THERAPIES CANBAS CO., LTD. (JP) 2005-02-17 WO claimed
US-20040198727-A1 Compounds that abrogate DNA-damage-induced cell cycle G2 checkpoint and/or augment the anti-cancer activity of DNA damaging treatments CANBAS CO., LTD. (JP) 2004-10-07 US claimed
WO-2003104181-A2 COMPOUNDS THAT ABROGATE DNA-DAMAGE-INDUCED CELL CYCLE G2 CHECKPOINT AND/OR AUGMENT THE ANTI-CANCER ACTIVITY OF DNA-DAMAGING TREATMENTS CANBAS CO. LTD. (JP) 2003-12-18 WO claimed
US-8263268-B2 Ester compound, and non-aqueous electrolyte solution and lithium secondary battery each using the ester compound UBE INDUSTRIES, LTD. (JP) 2012-09-11 US disclosed
EP-2108640-B1 ESTER COMPOUND, AND NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY EACH USING THE ESTER COMPOUND UBE INDUSTRIES (JP) 2012-07-25 EP disclosed
EP-1511713-B8 COMPOUNDS THAT ABROGATE DNA-DAMAGE-INDUCED CELL CYCLE G2 CHECKPOINT AND/OR AUGMENT THE ANTI-CANCER ACTIVITY OF DNA-DAMAGING TREATMENTS CANBAS CO LTD (JP) 2012-02-08 EP disclosed
EP-1511713-B1 COMPOUNDS THAT ABROGATE DNA-DAMAGE-INDUCED CELL CYCLE G2 CHECKPOINT AND/OR AUGMENT THE ANTI-CANCER ACTIVITY OF DNA-DAMAGING TREATMENTS CANBAS CO LTD (JP) 2011-08-17 EP disclosed
EP-1511713-A2 COMPOUNDS THAT ABROGATE DNA-DAMAGE-INDUCED CELL CYCLE G2 CHECKPOINT AND/OR AUGMENT THE ANTI-CANCER ACTIVITY OF DNA-DAMAGING TREATMENTS Canbas Co. Ltd. (JP) 2005-03-09 EP disclosed
WO-2005014856-A1 SENSITIVITY TEST TO PREDICT EFFICACY OF ANTI-CANCER THERAPIES CANBAS CO., LTD. (JP) 2005-02-17 WO disclosed
US-20040198727-A1 Compounds that abrogate DNA-damage-induced cell cycle G2 checkpoint and/or augment the anti-cancer activity of DNA damaging treatments CANBAS CO., LTD. (JP) 2004-10-07 US disclosed
WO-2003104181-A2 COMPOUNDS THAT ABROGATE DNA-DAMAGE-INDUCED CELL CYCLE G2 CHECKPOINT AND/OR AUGMENT THE ANTI-CANCER ACTIVITY OF DNA-DAMAGING TREATMENTS CANBAS CO. LTD. (JP) 2003-12-18 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 (3 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-20040198727-A1 Compounds that abrogate DNA-damage-induced cell cycle G2 checkpoint and/or augment the anti-cancer activity of DNA damaging treatments CDC25C, CHEK1, DDB1 LMNA 842/4885ALDH1A1 1521/4885KMT2A 766/4885
US-20080227827-A1 COMPOUNDS THAT ABROGATE DNA DAMAGE INDUCED CELL CYCLE G2 CHECKPOINT AND/OR AUGMENT ANTI-CANCER ACTIVITY OF DNA-DAMAGING TREATMENTS CDC25C, CHEK1, CDC25A LMNA 747/4885ALDH1A1 1685/4885KMT2A 883/4885
US-20060122269-A1 Compounds that abrogate DNA damage induced cell cycle G2 checkpoint and/or augment anti-cancer activity of DNA-damaging treatments CDC25C, CHEK1, CDC25A LMNA 747/4885ALDH1A1 1685/4885KMT2A 883/4885

“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.