SCHEMBL4298273

SCHEMBL4298273

Cc1cc(C)c(OC/C=C\COc2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
MAPT P10636 3/20 0.39
GLA P06280 1/20 0.39
HTR1A P08908 3/20 0.37
MEN1 O00255 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ATM Q13315 1/20 0.33
SCN4A P35499 2/20 0.32

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
SCHEMBL4298275 1.00 KMT2A (0.40) KMT2AMAPTGLAHTR1AMEN1
SCHEMBL26241247 0.92 KMT2A (0.36) KMT2AMAPTGLAHTR1AMEN1
SCHEMBL13313287 0.92 KMT2A (0.36) KMT2AMAPTGLAHTR1AMEN1
SCHEMBL8161008 0.82 POLB (0.39) KMT2AMAPTGLAHTR1AMEN1
SCHEMBL14380668 0.78 KMT2A (0.33) KMT2A
SCHEMBL11586155 0.75 MAPT (0.43) KMT2AMAPTGLAHTR1AMEN1
SCHEMBL7283882 0.74 SRC (0.50) KMT2AMAPTMEN1L3MBTL1KDM4E
SCHEMBL7283891 0.74 SRC (0.50) KMT2AMAPTMEN1L3MBTL1KDM4E
SCHEMBL292606 0.73 KMT2A (0.41) KMT2AMAPTGLAHTR1AMEN1
SCHEMBL2092535 0.73 KMT2A (0.41) KMT2AMAPTGLAHTR1AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275664-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES PROGEN PHARMACEUTICALS, INC. 2009-11-05 US disclosed
US-20080194697-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES CELLGATE, INC. 2008-08-14 US disclosed
US-7312244-B2 Polyamine analog-amino acid conjugates useful as anticancer agents CELLGATE, INC. (US) 2007-12-25 US disclosed
US-7279502-B2 Polyamine analog conjugates and quinone conjugates as therapies for cancers and prostate diseases CELLGATE, INC. (US) 2007-10-09 US disclosed
US-20070161692-A1 Conformationally restricted polyamine analogs as disease therapies CELLGATE, INC. (US) 2007-07-12 US disclosed
US-7186825-B2 Conformationally restricted polyamine analogs as disease therapies CELLGATE, INC. (US) 2007-03-06 US disclosed
EP-1698629-A2 Polyamines and their use in therapy Cellgate, Inc. (US) 2006-09-06 EP disclosed
EP-1177197-B1 POLYAMINES AND THEIR USE IN THERAPY CELLGATE INC (US) 2006-08-09 EP disclosed
US-20050233943-A1 Novel polyamine analog conjugates and quinone conjugates as therapies for cancers and prostate diseases CELLGATE, INC. 2005-10-20 US disclosed
EP-1337504-A4 NOVEL POLYAMINE ANALOG-AMINO ACID CONJUGATES USEFUL AS ANTICANCER AGENTS CELLGATE INC (US) 2005-10-05 EP disclosed
US-20040235962-A1 Conformationally restricted polyamine analogs as disease therapies CELLGATE, INC. 2004-11-25 US disclosed
US-6794545-B1 INCREASES IN THE POLYAMINE POOL SUPPRESS POLYAMINE BIOSYNTHESIS ALSO INHIBIT CELL GROWTH; ANTIPROLIFERATIVE AGENT SLIL BIOMEDICAL CORPORATION 2004-09-21 US disclosed
US-20040133013-A1 Novel polyamine analog-amino acid conjugates useful as anticancer agents CELLGATE, INC. 2004-07-08 US disclosed
US-20040006049-A1 Novel polyamine analog conjugates and quinone conjugates as therapies for cancers and prostate diseases SLIL BIOMEDICAL CORPORATION (US) 2004-01-08 US disclosed
US-6649587-B1 Cytostatic or cytocidal componenet conjugated to a polypeptide recognized and cleaved by enzymes such as prostate specific antigen (PSA) and cathepsin B SLIL BIOMEDICAL CORPORATION 2003-11-18 US disclosed
EP-1337504-A2 NOVEL POLYAMINE ANALOG-AMINO ACID CONJUGATES USEFUL AS ANTICANCER AGENTS Slil Biomedical Corporation (US) 2003-08-27 EP disclosed
WO-2002038105-A2 NOVEL POLYAMINE ANALOG-AMINO ACID CONJUGATES USEFUL AS ANTICANCER AGENTS SLIL BIOMEDICAL CORPORATION (US) 2002-05-16 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 (7 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-20040235962-A1 Conformationally restricted polyamine analogs as disease therapies SRM, PYCR1, PAICS KMT2A 376/4885MAPT 782/4885GLA 4226/4885
US-20070161692-A1 Conformationally restricted polyamine analogs as disease therapies SRM, PYCR1, PAICS KMT2A 376/4885MAPT 782/4885GLA 4226/4885
US-20040006049-A1 Novel polyamine analog conjugates and quinone conjugates as therapies for cancers and prostate diseases CTSB, CTSL, CTSV KMT2A 2180/4885MAPT 3032/4885GLA 565/4885
US-20040133013-A1 Novel polyamine analog-amino acid conjugates useful as anticancer agents SLC7A1, SRM, PAICS KMT2A 419/4885MAPT 2646/4885GLA 3891/4885
US-20080194697-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES CTSB, KLK3, FOLH1 KMT2A 1702/4885MAPT 2473/4885GLA 616/4885
US-20050233943-A1 Novel polyamine analog conjugates and quinone conjugates as therapies for cancers and prostate diseases CTSB, CTSL, CTSV KMT2A 2180/4885MAPT 3032/4885GLA 565/4885
US-20090275664-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES CTSB, CTSL, CTSV KMT2A 2180/4885MAPT 3032/4885GLA 565/4885

“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.