SCHEMBL17817815

SCHEMBL17817815

c1ccc(COc2cc(N3c4ccccc4Oc4ccccc43)ccc2-c2nc3ccccc3s2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.40
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
MAPT P10636 3/20 0.40
NPSR1 Q6W5P4 3/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
ALDH1A1 P00352 3/20 0.39
GLA P06280 2/20 0.39
GAA P10253 2/20 0.39
HPGD P15428 2/20 0.39
S1PR2 O95136 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 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
SCHEMBL18875166 0.83 KDM4E (0.46) KDM4ENPC1RAB9AMAPTNPSR1
SCHEMBL17817806 0.81 MAPT (0.56) KDM4ENPC1RAB9AMAPTNPSR1
SCHEMBL17817808 0.79 SGMS2 (0.45) KDM4ENPC1RAB9AMAPTNPSR1
SCHEMBL17817812 0.77 NPC1 (0.49) KDM4ENPC1RAB9AMAPTNPSR1
SCHEMBL18875207 0.77 KDM4E (0.41) KDM4ENPC1RAB9AMAPTNPSR1
SCHEMBL17867470 0.77 KDM4E (0.39) KDM4ENPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL17038495 0.77 RAB9A (0.60) KDM4ENPC1RAB9AMAPTNPSR1
SCHEMBL19766157 0.76 KDM4E (0.40) KDM4ENPC1RAB9AMAPTNPSR1
SCHEMBL18875314 0.74 KDM4E (0.38) KDM4ENPC1RAB9AMAPTNPSR1
SCHEMBL18875196 0.74 RECQL (0.38) KDM4ENPC1RAB9AMAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105636949-B Organometallic complex, light-emitting material, delayed phosphor, and organic light-emitting element 国立大学法人九州大学 2018-11-20 CN disclosed
US-9957260-B2 Organic metal complex, light emitting material, delayed fluorescent material, and organic light emitting device KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2018-05-01 US disclosed
US-9957260-B2 Organic metal complex, light emitting material, delayed fluorescent material, and organic light emitting device KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2018-05-01 US disclosed
US-9957260-B2 Organic metal complex, light emitting material, delayed fluorescent material, and organic light emitting device KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2018-05-01 US disclosed
US-20160185765-A1 ORGANIC METAL COMPLEX, LIGHT EMITTING MATERIAL, DELAYED FLUORESCENT MATERIAL, AND ORGANIC LIGHT EMITTING DEVICE DYDEN CO (JP) 2016-06-30 US disclosed
US-20160185765-A1 ORGANIC METAL COMPLEX, LIGHT EMITTING MATERIAL, DELAYED FLUORESCENT MATERIAL, AND ORGANIC LIGHT EMITTING DEVICE DYDEN CO (JP) 2016-06-30 US disclosed
US-20160185765-A1 ORGANIC METAL COMPLEX, LIGHT EMITTING MATERIAL, DELAYED FLUORESCENT MATERIAL, AND ORGANIC LIGHT EMITTING DEVICE DYDEN CO (JP) 2016-06-30 US disclosed
EP-3031805-A1 ORGANIC METAL COMPLEX, LUMINESCENT MATERIAL, DELAYED PHOSPHOR AND ORGANIC LIGHT EMITTING ELEMENT Kyushu University, National University Corporation (JP) 2016-06-15 EP disclosed
CN-105636949-A Organometallic complex, light-emitting material, delayed phosphor, and organic light-emitting element NAT UNIV CORP KYUSHU UNIV 2016-06-01 CN 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-20160185765-A1 ORGANIC METAL COMPLEX, LIGHT EMITTING MATERIAL, DELAYED FLUORESCENT MATERIAL, AND ORGANIC LIGHT EMITTING DEVICE OR10J3, SOD1, H1-10 KDM4E 2408/4885NPC1 3750/4885RAB9A 1360/4885

“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.