SCHEMBL9256060

SCHEMBL9256060

Fc1ccc(Nc2c3c(nc4ccc(C5CCCCC5)cc24)CCCC3)cc1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.60
GAA P10253 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
LMNA P02545 1/20 0.60
HTT P42858 1/20 0.60
GFER P55789 1/20 0.60
SOS1 Q07889 2/20 0.58
ACHE P22303 8/20 0.53
MAPT P10636 2/20 0.49
POLB P06746 2/20 0.49
RAD52 P43351 1/20 0.49
KMT2A Q03164 4/20 0.49
NPSR1 Q6W5P4 2/20 0.49
MEN1 O00255 1/20 0.47
BCHE P06276 3/20 0.46
GRIN1 Q05586 3/20 0.46
GRIN2A Q12879 3/20 0.46
HDAC6 Q9UBN7 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43

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
SCHEMBL9252705 0.90 ACHE (0.65) TP53GAASMN1; SMN2LMNAHTT
SCHEMBL10699871 0.89 ACHE (0.65) TP53GAASMN1; SMN2LMNAGFER
SCHEMBL9253451 0.89 ACHE (0.67) TP53GAASMN1; SMN2LMNAHTT
SCHEMBL9261276 0.85 ACHE (0.68) TP53GAASMN1; SMN2LMNAHTT
SCHEMBL9252906 0.84 ACHE (0.60) TP53GAASMN1; SMN2LMNAHTT
SCHEMBL9257198 0.82 ACHE (0.47) TP53SMN1; SMN2ACHEKMT2ANPSR1
SCHEMBL9253349 0.80 ACHE (0.58) HTTACHEKMT2AMEN1BCHE
SCHEMBL9261779 0.80 ACHE (0.48) TP53SMN1; SMN2ACHEKMT2ANPSR1
SCHEMBL9257365 0.79 ACHE (0.61) ACHEBCHE
SCHEMBL9263594 0.77 ACHE (0.69) TP53GAASMN1; SMN2LMNAHTT

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-5391553-A Increasing cholinergic functionin mammals HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-02-21 US disclosed