SCHEMBL1542680

SCHEMBL1542680

OC(c1cc(Br)cc(Br)c1)c1cc(Br)cc(Br)c1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
GABRA1 P14867 2/20 0.35
GABRB1 P18505 2/20 0.35
GABRA2 P47869 1/20 0.32
GABRB2 P47870 1/20 0.32
IDO1 P14902 1/20 0.30
TDO2 P48775 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
SCHEMBL6480579 0.85 SMN1; SMN2 (0.45) TSHRTDP1IDO1TDO2
SCHEMBL8593031 0.82 NR3C1 (0.41) IDO1TDO2
SCHEMBL344624 0.77 GABRA1 (0.42) CYP3A4TSHRTDP1GABRA1GABRB1
SCHEMBL8305941 0.77 GABRA1 (0.42) CYP3A4TSHRTDP1GABRA1GABRB1
SCHEMBL28230226 0.77 CYP3A4 (0.33) CYP3A4TSHRTDP1GABRA1GABRB1
SCHEMBL17295657 0.73 BRD4 (0.46) IDO1TDO2
SCHEMBL4093326 0.73 CYP3A4 (0.33) CYP3A4TSHRTDP1GABRA1GABRB1
SCHEMBL241692 0.73 IDO1 (0.47) CYP3A4IDO1TDO2
SCHEMBL7787305 0.73 CYP3A4 (0.31) CYP3A4TSHRTDP1GABRA1GABRB1
SCHEMBL8593033 0.72 BRD4 (0.43) CYP3A4IDO1TDO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160240782-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICE MERCK PATENT GMBH (DE) 2016-08-18 US disclosed
US-20160240782-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICE MERCK PATENT GMBH (DE) 2016-08-18 US disclosed
US-20160240782-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICE MERCK PATENT GMBH (DE) 2016-08-18 US disclosed
US-9203031-B2 Organic light emitting display devices and methods of manufacturing organic light emitting display devices SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-01 US disclosed
US-9203031-B2 Organic light emitting display devices and methods of manufacturing organic light emitting display devices SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-01 US disclosed
EP-2307520-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2015-11-11 EP disclosed
US-20130001530-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICES AND METHODS OF MANUFACTURING ORGANIC LIGHT EMITTING DISPLAY DEVICES SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2013-01-03 US disclosed
US-20130001530-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICES AND METHODS OF MANUFACTURING ORGANIC LIGHT EMITTING DISPLAY DEVICES SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2013-01-03 US disclosed
US-20110140043-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICE MERCK PATENT GMBH (DE) 2011-06-16 US disclosed
US-20110140043-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICE MERCK PATENT GMBH (DE) 2011-06-16 US disclosed
US-20110140043-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICE MERCK PATENT GMBH (DE) 2011-06-16 US disclosed
EP-2307520-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES Merck Patent GmbH (DE) 2011-04-13 EP disclosed
WO-2010006680-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2010-01-21 WO disclosed
WO-2010006680-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2010-01-21 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-20110140043-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICE L1CAM, SLCO4C1, GJA1 CYP3A4 1644/4885TSHR 4342/4885TDP1 2195/4885
US-20160240782-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICE L1CAM, SLCO4C1, GJA1 CYP3A4 1644/4885TSHR 4342/4885TDP1 2195/4885

“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.