SCHEMBL5408962

SCHEMBL5408962

CCCCC[C]1C=CCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.37
BACE1 P56817 1/20 0.37
PTGS2 P35354 7/20 0.33
MGLL Q99685 3/20 0.33
CYP3A4 P08684 2/20 0.33
FAAH O00519 2/20 0.33
TRPA1 O75762 1/20 0.33
GPR84 Q9NQS5 4/20 0.33
PTGS1 P23219 4/20 0.32
ESR1 P03372 2/20 0.32
ADRA2A P08913 2/20 0.32
ADORA3 P0DMS8 2/20 0.32
TACR2 P21452 2/20 0.32
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A3 Q01959 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
SHBG P04278 1/20 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
SCHEMBL9214094 0.98 ACHE (0.40) ACHEBACE1PTGS2MGLLCYP3A4
SCHEMBL9214003 0.98 ACHE (0.40) ACHEBACE1PTGS2MGLLCYP3A4
SCHEMBL9207365 0.98 ACHE (0.40) ACHEBACE1PTGS2MGLLCYP3A4
SCHEMBL9214278 0.98 ACHE (0.40) ACHEBACE1PTGS2MGLLCYP3A4
SCHEMBL62390 0.98 ACHE (0.40) ACHEBACE1PTGS2MGLLCYP3A4
SCHEMBL9211600 0.98 ACHE (0.40) ACHEBACE1PTGS2MGLLCYP3A4
SCHEMBL9213345 0.98 ACHE (0.40) ACHEBACE1PTGS2MGLLCYP3A4
SCHEMBL5403812 0.93
SCHEMBL1525180 0.88 ALDH1A1 (0.40) ACHEBACE1PTGS2MGLLCYP3A4
SCHEMBL9215043 0.88 MGLL (0.45) MGLLFAAHALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7192684-B2 Polymerizable silicon-containing compound, manufacturing method, polymer, resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2007-03-20 US disclosed
US-20040067436-A1 Polymerizable silicon-containing compound, manufacturing method, polymer, resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2004-04-08 US disclosed
EP-0421441-B1 Pantothenic acid derivatives FUJIREBIO KK (JP) 1995-01-25 EP disclosed
US-5120738-A Cardiovascular disorders FUJIREBIO INC. (JP) 1992-06-09 US disclosed
EP-0421441-A2 Pantothenic acid derivatives FUJIREBIO INC. (JP) 1991-04-10 EP disclosed