SCHEMBL3339737

SCHEMBL3339737

CCCCCCCCCCn1c2ccc(Br)cc2c2cc(Br)ccc21

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.54
PSEN1 P49768 4/20 0.52
PSEN2 P49810 4/20 0.52
APH1B Q8WW43 4/20 0.52
NCSTN Q92542 4/20 0.52
APH1A Q96BI3 4/20 0.52
PSENEN Q9NZ42 4/20 0.52
CNR2 P34972 10/20 0.48
MAPT P10636 2/20 0.46
RORA P35398 1/20 0.45
RORC P51449 1/20 0.45
RORB Q92753 1/20 0.45
DNM1 Q05193 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL28299672 1.00 SIGMAR1 (0.54) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL751367 1.00 SIGMAR1 (0.54) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL3823482 1.00 SIGMAR1 (0.54) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL29779351 1.00 SIGMAR1 (0.54) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL29393803 1.00 SIGMAR1 (0.54) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL11127173 1.00 SIGMAR1 (0.54) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL11909992 0.98 SIGMAR1 (0.55) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL926107 0.97 PSEN1 (0.53) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL28014993 0.97 PSEN1 (0.53) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL28585812 0.94 PSEN1 (0.58) SIGMAR1PSEN1PSEN2APH1BNCSTN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7727690-B2 Iridium complex, carbazole derivatives and copolymer having the same GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2010-06-01 US disclosed
EP-1923385-B1 Iridium complex, carbazole derivatives and copolymer having the same KWANGJU INST SCI & TECH (KR) 2009-05-27 EP disclosed
US-20080177084-A1 IRIDIUM COMPLEX, CARBAZOLE DERIVATIVES AND COPOLYMER HAVING THE SAME GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2008-07-24 US disclosed
EP-1923385-A1 Iridium complex, carbazole derivatives and copolymer having the same Gwangju Institute of Science and Technology (KR) 2008-05-21 EP disclosed
US-20080054794-A1 Organic Electroluminescence Device, Image Display Apparatus and Lighting Apparatus Including the Same, Charge Transport Material and Charge Transport Layer Forming Ink Including the Same Fujiki, Michiya (JP) 2008-03-06 US disclosed
WO-2006001469-A2 ORGANIC ELECTROLUMINESCENCE DEVICE, IMAGE DISPLAY APPARATUS AND LIGHTING APPARATUS INCLUDING THE SAME CHARGE TRANSPORT MATERIAL SHARP KABUSHIKI KAISHA (JP) 2006-01-05 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-20080177084-A1 IRIDIUM COMPLEX, CARBAZOLE DERIVATIVES AND COPOLYMER HAVING THE SAME INTS9, HIRIP3, HELZ SIGMAR1 3086/4885PSEN1 4666/4885PSEN2 4756/4885

“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.