SCHEMBL7638429

SCHEMBL7638429

CCCCCCCCNc1cc(OCCCC)nc(N)n1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 4/20 0.56
DNM2 P50570 10/20 0.43
NUDT1 P36639 1/20 0.41
SOAT1 P35610 2/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
GLA P06280 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL20434304 0.81 TLR8 (0.65) TLR8ALDH1A1LMNATSHR
SCHEMBL30263108 0.80 TLR8 (0.64) TLR8DNM2SOAT1
SCHEMBL29156884 0.80 TLR8 (0.64) TLR8DNM2SOAT1
SCHEMBL2990823 0.79 CDK1 (0.46) TLR8NUDT1MEN1ALDH1A1LMNA
SCHEMBL5791298 0.79 TLR8 (0.88) TLR8DNM2MEN1ALDH1A1LMNA
SCHEMBL7117794 0.78 CYP2D6 (0.62) TLR8DNM2ALDH1A1KMT2A
SCHEMBL7118699 0.78 CYP2D6 (0.62) TLR8DNM2ALDH1A1KMT2A
SCHEMBL7135338 0.78 CYP2D6 (0.62) TLR8DNM2ALDH1A1KMT2A
SCHEMBL7124897 0.78 CYP2D6 (0.62) TLR8DNM2ALDH1A1KMT2A
SCHEMBL16703349 0.78 CYP2D6 (0.62) TLR8DNM2ALDH1A1KMT2A

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-6455054-B2 THERAPY FOR SKIN DISORDERS SOCIETE L'OREAL S.A. (FR) 2002-09-24 US disclosed