SCHEMBL9368362

SCHEMBL9368362

CCCCCCCCCCCCCc1nccn1C(C)C

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 4/20 0.40
TLR8 Q9NR97 2/20 0.38
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
CCNB2 O95067 1/20 0.35
CDK1 P06493 1/20 0.35
CCNB1 P14635 1/20 0.35
CCNB3 Q8WWL7 1/20 0.35
KCNH2 Q12809 2/20 0.34
ADA P00813 1/20 0.34
CETP P11597 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL5301036 1.00 TLR7 (0.40) TLR7TLR8ALDH1A1POLBKMT2A
SCHEMBL9368609 1.00 TLR7 (0.40) TLR7TLR8ALDH1A1POLBKMT2A
SCHEMBL5283427 1.00 TLR7 (0.40) TLR7TLR8ALDH1A1POLBKMT2A
SCHEMBL5297925 1.00 TLR7 (0.40) TLR7TLR8ALDH1A1POLBKMT2A
SCHEMBL9444351 0.98 TLR7 (0.39) TLR7TLR8ALDH1A1POLBKMT2A
SCHEMBL9700469 0.91 MGLL (0.37) TLR7
SCHEMBL9700482 0.91 MGLL (0.37) TLR7
SCHEMBL1962600 0.87 TLR7 (0.38) TLR7TLR8ALDH1A1POLBKMT2A
SCHEMBL21494322 0.87 TLR7 (0.38) TLR7TLR8ALDH1A1POLBKMT2A
SCHEMBL9408463 0.87 TLR7 (0.38) TLR7TLR8ALDH1A1POLBKMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0378910-B1 Method for the preparation of imidazoles TEXACO DEVELOPMENT CORP (US) 1994-08-31 EP disclosed
EP-0378910-A1 Method for the preparation of imidazoles TEXACO DEVELOPMENT CORPORATION (US) 1990-07-25 EP disclosed
US-4921969-A Method for the preparation of imidazoles TEXACO CHEMICAL CO. (US) 1990-05-01 US disclosed