SCHEMBL4243301

SCHEMBL4243301

CC1(C)c2cc(Br)ccc2-c2cc3cc4ccc(Br)cc4cc3cc21

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP2A6 P11509 1/20 0.39
PDK2 Q15119 1/20 0.38
NCEH1 Q6PIU2 1/20 0.32
AKR1A1 P14550 1/20 0.31
AKR1B1 P15121 1/20 0.31
S100A4 P26447 1/20 0.31
LMNA P02545 1/20 0.30
TDP2 O95551 1/20 0.30
BACE1 P56817 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL2790308 1.00 KDM4E (0.41) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL16683880 0.98 KDM4E (0.42) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL2606599 0.97 KDM4E (0.41) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL2790733 0.92 PDK2 (0.44) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL2793382 0.89 CYP2A6 (0.44) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL29562304 0.88 PDK2 (0.46) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL13828827 0.88 PDK2 (0.46) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL19197207 0.88 CYP2A6 (0.55) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL29383770 0.88 PDK2 (0.46) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL31197665 0.87 PDK2 (0.36) KDM4EMEN1ALDH1A1MAPTKMT2A

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
WO-2014104666-A1 INK COMPOSITION FOR ORGANIC ELECTRONIC ELEMENT, AND ORGANIC ELECTRONIC ELEMENT USING SAME 주식회사 두산 (KR) 2014-07-03 WO disclosed
WO-2014104666-A1 INK COMPOSITION FOR ORGANIC ELECTRONIC ELEMENT, AND ORGANIC ELECTRONIC ELEMENT USING SAME 주식회사 두산 (KR) 2014-07-03 WO disclosed
US-8395144-B2 Anthracene derivatives and organic electroluminescent device using same DOOSAN CORPORATION (KR) 2013-03-12 US disclosed
US-8395144-B2 Anthracene derivatives and organic electroluminescent device using same DOOSAN CORPORATION (KR) 2013-03-12 US disclosed
US-8395144-B2 Anthracene derivatives and organic electroluminescent device using same DOOSAN CORPORATION (KR) 2013-03-12 US disclosed
US-20110057182-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME DOOSAN CORPORATION (KR) 2011-03-10 US disclosed
US-20110057182-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME DOOSAN CORPORATION (KR) 2011-03-10 US disclosed
US-20110057182-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME DOOSAN CORPORATION (KR) 2011-03-10 US disclosed
WO-2009139580-A2 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2009-11-19 WO disclosed
WO-2009139580-A2 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2009-11-19 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 (1 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-20110057182-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME TRPA1, AHR, ORAI2 KDM4E 978/4885MEN1 2444/4885ALDH1A1 216/4885

“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.