SCHEMBL796967

SCHEMBL796967

CC(C)(O)c1ccccc1Nc1ccc(Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
MAPT P10636 4/20 0.39
NPC1 O15118 3/20 0.39
LMNA P02545 3/20 0.39
RAB9A P51151 2/20 0.39
KCNH3 Q9ULD8 1/20 0.39
IDH1 O75874 1/20 0.38
PDK1 Q15118 1/20 0.38
PDK2 Q15119 1/20 0.38
PDK3 Q15120 1/20 0.38
PDK4 Q16654 1/20 0.38
MPI P34949 1/20 0.38
DHODH Q02127 1/20 0.37
AKR1C3 P42330 2/20 0.37
AKR1C2 P52895 2/20 0.37
POLB P06746 3/20 0.37
HSD11B1 P28845 1/20 0.36
ACP1 P24666 1/20 0.36

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
SCHEMBL12109310 0.86 PTGER4 (0.39) MEN1KMT2ASMN1; SMN2MAPTNPC1
SCHEMBL31916 0.85 MAPT (0.47) MEN1KMT2ASMN1; SMN2MAPTNPC1
SCHEMBL17617068 0.83 MEN1 (0.41) MEN1KMT2ASMN1; SMN2MAPTNPC1
SCHEMBL13286497 0.79 CXCR2 (0.41) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL1302379 0.79 ACP1 (0.40) MEN1KMT2AMAPTNPC1LMNA
SCHEMBL25224147 0.75 ALDH1A1 (0.60) KMT2ASMN1; SMN2MAPTNPC1LMNA
SCHEMBL24268313 0.72 SIRT2 (0.52) MEN1KMT2AMAPTAKR1C3POLB
SCHEMBL21324640 0.72 MET (0.41) DHODH
SCHEMBL12109361 0.72 PDK2 (0.39) PDK2
SCHEMBL15692452 0.72 ALDH1A1 (0.51) SMN1; SMN2MAPTNPC1LMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10177312-B2 Compounds for electronic devices MERCK PATENT GMBH (DE) 2019-01-08 US disclosed
US-10177312-B2 Compounds for electronic devices MERCK PATENT GMBH (DE) 2019-01-08 US disclosed
US-10056549-B2 Compounds for electronic devices MERCK PATENT GMBH (DE) 2018-08-21 US disclosed
US-9947874-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2018-04-17 US disclosed
US-9947874-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2018-04-17 US disclosed
US-9708262-B2 Compounds for electronic devices MERCK PATENT GMBH (DE) 2017-07-18 US disclosed
US-9708262-B2 Compounds for electronic devices MERCK PATENT GMBH (DE) 2017-07-18 US disclosed
EP-2705550-B1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-07-05 EP disclosed
EP-2705550-B1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-07-05 EP disclosed
CN-106083848-A Compound for electronic device 默克专利有限公司 2016-11-09 CN disclosed
US-20120292576-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-11-22 US disclosed
US-20120292576-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-11-22 US disclosed
WO-2012150001-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-11-08 WO disclosed
WO-2012150001-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-11-08 WO disclosed
WO-2012149999-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-11-08 WO disclosed
WO-2012149999-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-11-08 WO disclosed
WO-2012034627-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 WO disclosed
WO-2012034627-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 WO disclosed
WO-2011088877-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2011-07-28 WO disclosed
WO-2011088877-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2011-07-28 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 (2 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-10056549-B2 Compounds for electronic devices CYP2C19, CYP2D6, CYP1B1 MEN1 110/4885KMT2A 1993/4885SMN1; SMN2 2974/4885
US-20120292576-A1 COMPOUNDS FOR ELECTRONIC DEVICES SLCO4C1, SLCO1A2, SLCO2A1 MEN1 575/4885KMT2A 2324/4885SMN1; SMN2 3425/4885

“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.