SCHEMBL20021514

SCHEMBL20021514

CCCCCCCCn1c2ccccc2c2cc(-c3ccc(-c4ccc(-c5ccc(-c6ccc7c(c6)c6ccccc6n7CCCCCCCC)s5)c5nsnc45)s3)ccc21

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 17/20 0.44
▸ PSEN1 P49768 3/20 0.43
▸ PSEN2 P49810 3/20 0.43
▸ APH1B Q8WW43 3/20 0.43
▸ NCSTN Q92542 3/20 0.43
▸ APH1A Q96BI3 3/20 0.43
▸ PSENEN Q9NZ42 3/20 0.43
▸ CNR1 P21554 1/20 0.41

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
SCHEMBL20021512 0.99 CNR2 (0.43) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL20021526 0.99 CNR2 (0.43) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL20022376 0.96 CNR2 (0.41) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL20021519 0.87 CNR2 (0.53) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL20021511 0.87 CNR2 (0.53) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL20021528 0.87 CNR2 (0.53) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL20021527 0.87 CNR2 (0.53) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL20021506 0.87 CNR2 (0.53) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL12379833 0.85 PSEN1 (0.52) CNR2PSEN1PSEN2APH1BNCSTN
SCHEMBL20022299 0.84 CNR2 (0.50) CNR2PSEN1PSEN2APH1BNCSTN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180094192-A1 POLYMER NETWORKS UNIVERSITY OF HULL (GB) 2018-04-05 — — US disclosed
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