SCHEMBL9901332

SCHEMBL9901332

CCCCCCCCCCCCn1c2ccccc2c2cc3cc4c(cc3cc21)c1ccccc1n4CCCCCCCCCCCC

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 11/20 0.58
PSEN2 P49810 11/20 0.58
APH1B Q8WW43 11/20 0.58
NCSTN Q92542 11/20 0.58
APH1A Q96BI3 11/20 0.58
PSENEN Q9NZ42 11/20 0.58
CNR2 P34972 8/20 0.58
PGR P06401 1/20 0.53
RORA P35398 1/20 0.53
RORC P51449 1/20 0.53
RORB Q92753 1/20 0.53

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
SCHEMBL9976723 0.92 PSEN1 (0.62) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL551644 0.92 PSEN1 (0.62) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9905344 0.92 PSEN1 (0.62) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14107129 0.92 PSEN1 (0.62) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL554428 0.90 CNR2 (0.63) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6275417 0.88 PGR (0.64) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6278388 0.88 PGR (0.64) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6774209 0.88 PGR (0.64) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6575875 0.88 PGR (0.64) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL750975 0.88 PGR (0.64) PSEN1PSEN2APH1BNCSTNAPH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130320269-A1 PROCESS FOR THE PREPARATION OF SEMICONDUCTOR MATERIALS, COMPOUNDS AND THEIR USE THE UNIVERSITY OF MANCHESTER (GB) 2013-12-05 US disclosed
EP-2649073-A2 PROCESS FOR THE PREPARATION OF SEMICONDUCTOR MATERIALS, COMPOUNDS AND THEIR USE The University Of Manchester (GB) 2013-10-16 EP disclosed
WO-2012076886-A2 NOVEL PROCESS AND COMPOUNDS THE UNIVERSITY OF MANCHESTER (GB) 2012-06-14 WO disclosed
WO-2012076886-A2 NOVEL PROCESS AND COMPOUNDS THE UNIVERSITY OF MANCHESTER (GB) 2012-06-14 WO disclosed