SCHEMBL796905

SCHEMBL796905

CCCc1c(C(=O)OC)c(C(=O)OC)c(CCC)c2cc3c(CCC)c4ccccc4c(CCC)c3cc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NR4A2 P43354 3/20 0.42
MAPK1 P28482 3/20 0.42
LMNA P02545 1/20 0.42
NCEH1 Q6PIU2 1/20 0.42
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
GAA P10253 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
NPSR1 Q6W5P4 1/20 0.39
CYP4F2 P78329 1/20 0.39

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
SCHEMBL6364973 0.94 NR4A2 (0.46) MEN1KMT2AATML3MBTL1NR4A2
SCHEMBL797383 0.89 KMT2A (0.43) MEN1KMT2AATML3MBTL1HPGD
SCHEMBL797153 0.87 MEN1 (0.44) MEN1KMT2AATML3MBTL1MAPK1
SCHEMBL10079130 0.86 MEN1 (0.42) MEN1KMT2AATML3MBTL1MAPK1
SCHEMBL10079131 0.84 MEN1 (0.43) MEN1KMT2AATML3MBTL1MAPK1
SCHEMBL13815350 0.83 MEN1 (0.42) MEN1KMT2AATML3MBTL1MAPK1
SCHEMBL10079141 0.82 NCEH1 (0.45) MEN1KMT2ANR4A2MAPK1LMNA
SCHEMBL797610 0.82 LDHA (0.50) MEN1KMT2ANCEH1KDM4EALDH1A1
SCHEMBL796328 0.82 KDM4E (0.40) MEN1KMT2AATML3MBTL1NR4A2
SCHEMBL797285 0.79 MTNR1A (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1262469-B1 POLYACENE DERIVATIVES AND PRODUCTION THEREOF JAPAN SCIENCE & TECH AGENCY (JP) 2012-01-11 EP claimed
US-7901594-B2 Electroconductivity JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2011-03-08 US claimed
US-8115197-B2 Organic semiconductor material, organic semiconductor thin film and organic semiconductor device SONY CORPORATION (JP) 2012-02-14 US disclosed
EP-1262469-B1 POLYACENE DERIVATIVES AND PRODUCTION THEREOF JAPAN SCIENCE & TECH AGENCY (JP) 2012-01-11 EP disclosed
US-7901594-B2 Electroconductivity JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2011-03-08 US disclosed
US-20090230387-A1 ORGANIC SEMICONDUCTOR MATERIAL, ORGANIC SEMICONDUCTOR THIN FILM AND ORGANIC SEMICONDUCTOR DEVICE SONY CORPORATION (JP) 2009-09-17 US disclosed
US-20090140241-A1 ORGANIC SEMICONDUCTOR MATERIAL, ORGANIC SEMICONDUCTOR THIN FILM AND ORGANIC SEMICONDUCTOR DEVICE SONY CORPORATION (JP) 2009-06-04 US disclosed
US-20050240061-A1 Functional thin film JAPAN SCIENCE AND TECHNOLOGY AGENCY 2005-10-27 US disclosed
EP-1493796-A1 FUNCTIONAL THIN FILM Japan Science and Technology Agency (JP) 2005-01-05 EP disclosed
US-20030116755-A1 Polyacene derivatives and production thereof JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2003-06-26 US disclosed
EP-1262469-A1 POLYACENE DERIVATIVES AND PRODUCTION THEREOF Japan Science and Technology Corporation (JP) 2002-12-04 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 (4 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-20090140241-A1 ORGANIC SEMICONDUCTOR MATERIAL, ORGANIC SEMICONDUCTOR THIN FILM AND ORGANIC SEMICONDUCTOR DEVICE H1-10, OR10J3, H1-0 MEN1 2302/4885KMT2A 873/4885ATM 2016/4885
US-20090230387-A1 ORGANIC SEMICONDUCTOR MATERIAL, ORGANIC SEMICONDUCTOR THIN FILM AND ORGANIC SEMICONDUCTOR DEVICE H1-10, OR10J3, H1-0 MEN1 2302/4885KMT2A 873/4885ATM 2016/4885
US-20050240061-A1 Functional thin film H1-10, H1-0, H1-2 MEN1 1195/4885KMT2A 647/4885ATM 3618/4885
US-20030116755-A1 Polyacene derivatives and production thereof CBR1, HVCN1, H1-0 MEN1 1980/4885KMT2A 1823/4885ATM 4137/4885

“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.