SCHEMBL29696476

SCHEMBL29696476

CC(C)CCCCCn1c2ccc(Br)cc2c2cc(Br)ccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.53
DNM1 Q05193 4/20 0.48
MAPT P10636 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
P2RX3 P56373 1/20 0.42
HTT P42858 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
POLB P06746 1/20 0.39
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38
BAX Q07812 1/20 0.38
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL28028937 1.00 SIGMAR1 (0.53) SIGMAR1DNM1MAPTSMN1; SMN2P2RX3
SCHEMBL31120931 0.93 POLB (0.48) SIGMAR1MAPTMEN1KMT2AMAOA
SCHEMBL28402672 0.88 SIGMAR1 (0.41) SIGMAR1DNM1MAPTSMN1; SMN2HTT
SCHEMBL5999998 0.85 SIGMAR1 (0.48) SIGMAR1DNM1MAPTSMN1; SMN2P2RX3
SCHEMBL6755578 0.85 SIGMAR1 (0.48) SIGMAR1DNM1MAPTSMN1; SMN2P2RX3
SCHEMBL6755616 0.85 SIGMAR1 (0.48) SIGMAR1DNM1MAPTSMN1; SMN2P2RX3
SCHEMBL31073662 0.82 SIGMAR1 (0.49) SIGMAR1DNM1MAPTSMN1; SMN2P2RX3
SCHEMBL11127173 0.82 SIGMAR1 (0.54) SIGMAR1DNM1MAPTSMN1; SMN2PSEN1
SCHEMBL751367 0.82 SIGMAR1 (0.54) SIGMAR1DNM1MAPTSMN1; SMN2PSEN1
SCHEMBL3823482 0.82 SIGMAR1 (0.54) SIGMAR1DNM1MAPTSMN1; SMN2PSEN1

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
CN-112521934-B Hyperbranched electroluminescent polymer, and polymerization monomer, preparation method and application thereof 华南理工大学 2022-07-26 CN disclosed