SCHEMBL10730218

SCHEMBL10730218

CCCCCCn1ccnc1C(OCC)(OCC)OCC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.51
POLB P06746 3/20 0.46
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 2/20 0.46
TBXAS1 P24557 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
HTT P42858 5/20 0.35
LMNA P02545 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35
CYP1A2 P05177 3/20 0.34
CYP2C19 P33261 3/20 0.34
GAA P10253 1/20 0.34
MEN1 O00255 1/20 0.34
CYP2C9 P11712 1/20 0.34
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
NPC1 O15118 5/20 0.32
RAB9A P51151 5/20 0.32

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
SCHEMBL10730692 1.00 TLR8 (0.51) TLR8POLBALDH1A1KMT2ATBXAS1
SCHEMBL10738786 0.94 ALDH1A1 (0.53) TLR8POLBALDH1A1KMT2AHTT
SCHEMBL10728812 0.85 ALDH1A1 (0.39) TLR8POLBALDH1A1KMT2ACNR1
SCHEMBL9006000 0.78 TLR8 (0.57) TLR8POLBALDH1A1KMT2ATBXAS1
SCHEMBL10740315 0.75 BRD4 (0.36) POLBALDH1A1KMT2AGAA
SCHEMBL28837797 0.74 TLR8 (0.57) TLR8POLBALDH1A1KMT2ATBXAS1
SCHEMBL25240227 0.72 ALDH1A1 (0.85) TLR8POLBALDH1A1KMT2ATBXAS1
SCHEMBL25267373 0.72 ALDH1A1 (0.85) TLR8POLBALDH1A1KMT2ATBXAS1
SCHEMBL5287541 0.72 ALDH1A1 (0.85) TLR8POLBALDH1A1KMT2ATBXAS1
SCHEMBL25270261 0.72 ALDH1A1 (0.85) TLR8POLBALDH1A1KMT2ATBXAS1

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-4698348-A 1H-imidazo[4,5-c]quinolines and their use as bronchodilating agents RIKER LABORATORIES, INC. (US) 1987-10-06 US disclosed