SCHEMBL8739988

SCHEMBL8739988

CCCCCCCCn1c2cc(C)sc2c2sc(C)cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.46
▸ ADRA2A P08913 1/20 0.39
▸ TLR8 Q9NR97 5/20 0.38
▸ PSEN1 P49768 3/20 0.38
▸ PSEN2 P49810 3/20 0.38
▸ APH1B Q8WW43 3/20 0.38
▸ NCSTN Q92542 3/20 0.38
▸ APH1A Q96BI3 3/20 0.38
▸ PSENEN Q9NZ42 3/20 0.38
▸ TP53 P04637 2/20 0.35
▸ PTGS1 P23219 3/20 0.35
▸ PTGS2 P35354 3/20 0.35
▸ MGLL Q99685 3/20 0.35
▸ FAAH O00519 2/20 0.35
▸ SLC9A1 P19634 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34

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
SCHEMBL15442929 0.93 PKM (0.42) PKMADRA2ATLR8KDM4ELMNA
SCHEMBL23731047 0.88 PKM (0.39) PKMADRA2ATLR8PSEN1PSEN2
SCHEMBL17124813 0.86 PKM (0.40) PKMTLR8PSEN1PSEN2APH1B
SCHEMBL12184971 0.81 PSEN1 (0.37) ADRA2ATLR8PSEN1PSEN2APH1B
SCHEMBL9988363 0.81 PSEN1 (0.37) ADRA2ATLR8PSEN1PSEN2APH1B
SCHEMBL14015488 0.81 PSEN1 (0.43) ADRA2ATLR8PSEN1PSEN2APH1B
SCHEMBL15274951 0.81 PSEN1 (0.37) ADRA2ATLR8PSEN1PSEN2APH1B
SCHEMBL4584716 0.81 PSEN1 (0.37) ADRA2ATLR8PSEN1PSEN2APH1B
SCHEMBL20978319 0.81 PSEN1 (0.37) ADRA2ATLR8PSEN1PSEN2APH1B
SCHEMBL15274946 0.81 PSEN1 (0.37) ADRA2ATLR8PSEN1PSEN2APH1B

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-8318894-B2 Charged polymers and their uses in electronic devices MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-11-27 — — US disclosed
US-20120130025-A1 CHARGED POLYMERS AND THEIR USES IN ELECTRONIC DEVICES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-05-24 — — US disclosed
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