SCHEMBL17010971

SCHEMBL17010971

CCCCCCn1c2ccc(Br)cc2c2sc(Br)cc21

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.41
▸ PSEN1 P49768 3/20 0.41
▸ PSEN2 P49810 3/20 0.41
▸ APH1B Q8WW43 3/20 0.41
▸ NCSTN Q92542 3/20 0.41
▸ APH1A Q96BI3 3/20 0.41
▸ PSENEN Q9NZ42 3/20 0.41
▸ CNR2 P34972 10/20 0.40
▸ GSK3B P49841 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL15274946 0.84 PSEN1 (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL12184971 0.84 PSEN1 (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL15274951 0.84 PSEN1 (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4584716 0.84 PSEN1 (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3823482 0.84 SIGMAR1 (0.54) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL751367 0.84 SIGMAR1 (0.54) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL3339737 0.84 SIGMAR1 (0.54) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL29779351 0.84 SIGMAR1 (0.54) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL11127173 0.84 SIGMAR1 (0.54) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL29393803 0.84 SIGMAR1 (0.54) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9112157-B2 Hole transport materials including OLED applications SOLVAY USA, INC. (US) 2015-08-18 — — US disclosed
US-9112157-B2 Hole transport materials including OLED applications SOLVAY USA, INC. (US) 2015-08-18 — — US disclosed
Send feedback