SCHEMBL1960937

SCHEMBL1960937

Clc1cc(Cl)cc(Sc2ccc(Sc3cc(Cl)cc(Cl)c3)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
MAOA P21397 3/20 0.44
MAOB P27338 3/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
RHEB Q15382 2/20 0.42
CYP3A4 P08684 2/20 0.41
NR1H2 P55055 1/20 0.41
MAPK1 P28482 1/20 0.41
POLB P06746 1/20 0.40
MAPT P10636 2/20 0.38
PDE7A Q13946 1/20 0.37
TP53 P04637 2/20 0.36
CHRNA7 P36544 1/20 0.36
CTRC Q99895 1/20 0.36
HAO1 Q9UJM8 1/20 0.35

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
SCHEMBL1962185 0.91 TSHR (0.57) TSHRMAOAMAOBMEN1KMT2A
SCHEMBL15207963 0.88 MAOA (0.47) TSHRMAOAMAOBMEN1KMT2A
SCHEMBL28423177 0.87 CHRNA7 (0.46) TSHRMAOAMAOBPOLBMAPT
SCHEMBL16864347 0.86 CYP3A4 (0.56) TSHRMAOAMAOBMEN1KMT2A
SCHEMBL3785704 0.81 CHRNA7 (0.46) TSHRMAOAMAOBPOLBMAPT
SCHEMBL1958579 0.81 POLB (0.44) TSHRMAOAMAOBMEN1KMT2A
SCHEMBL7190479 0.79 CYP3A4 (0.58) TSHRMAOAMAOBMEN1KMT2A
SCHEMBL9476350 0.78 MAOA (0.64) TSHRMAOAMAOBMEN1KMT2A
SCHEMBL481976 0.78 MAOA (0.64) TSHRMAOAMAOBMEN1KMT2A
SCHEMBL9475224 0.78 MAOA (0.64) TSHRMAOAMAOBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2332907-B1 ORGANIC SULFUR COMPOUND, PROCESS FOR PRODUCTION OF THE SAME, AND ORGANIC ELECTROLUMINESCENCE ELEMENT UTILIZING THE SAME UBE INDUSTRIES (JP) 2015-07-01 EP disclosed
EP-2332907-B1 ORGANIC SULFUR COMPOUND, PROCESS FOR PRODUCTION OF THE SAME, AND ORGANIC ELECTROLUMINESCENCE ELEMENT UTILIZING THE SAME UBE INDUSTRIES (JP) 2015-07-01 EP disclosed
US-8597799-B2 Organosulfur compound, process for producing the same, and organic electroluminescence element using the same UBE INDUSTRIES, LTD. (JP) 2013-12-03 US disclosed
US-20110140044-A1 ORGANOSULFUR COMPOUND, PROCESS FOR PRODUCING THE SAME, AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING THE SAME UBE INDUSTRIES, LTD. (JP) 2011-06-16 US disclosed
US-20110140044-A1 ORGANOSULFUR COMPOUND, PROCESS FOR PRODUCING THE SAME, AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING THE SAME UBE INDUSTRIES, LTD. (JP) 2011-06-16 US disclosed
US-20110140044-A1 ORGANOSULFUR COMPOUND, PROCESS FOR PRODUCING THE SAME, AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING THE SAME UBE INDUSTRIES, LTD. (JP) 2011-06-16 US disclosed
EP-2332907-A1 ORGANIC SULFUR COMPOUND, PROCESS FOR PRODUCTION OF THE SAME, AND ORGANIC ELECTROLUMINESCENCE ELEMENT UTILIZING THE SAME Ube Industries, Ltd. (JP) 2011-06-15 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 (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-20110140044-A1 ORGANOSULFUR COMPOUND, PROCESS FOR PRODUCING THE SAME, AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING THE SAME AS3MT, ARSA, ASH2L TSHR 1755/4885MAOA 1698/4885MAOB 1375/4885

“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.