SCHEMBL8518913

SCHEMBL8518913

OC(CC1CCCCCCCCC1)(C1CCCCCCCCC1)C1CCCCCCCCC1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.36
GRM2 Q14416 1/20 0.34
GRM3 Q14832 1/20 0.34
SIGMAR1 Q99720 3/20 0.33
HPGD P15428 2/20 0.32
METAP1 P53582 1/20 0.31
CHRM5 P08912 2/20 0.31
ADRA2C P18825 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM1 P11229 1/20 0.31
EPHX1 P07099 3/20 0.31
KMT2A Q03164 1/20 0.30
ALOX5 P09917 1/20 0.30

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
SCHEMBL16616932 1.00 CYP1A2 (0.36) CYP1A2GRM2GRM3SIGMAR1HPGD
SCHEMBL601051 0.80 CYP1A2 (0.36) CYP1A2GRM2GRM3SIGMAR1HPGD
SCHEMBL16974430 0.76 GRM2 (0.40) CYP1A2GRM2GRM3SIGMAR1HPGD
SCHEMBL28677325 0.76 CYP1A2 (0.40) CYP1A2GRM2GRM3SIGMAR1HPGD
SCHEMBL28659690 0.76 CYP1A2 (0.40) CYP1A2GRM2GRM3SIGMAR1HPGD
SCHEMBL28658445 0.76 CYP1A2 (0.40) CYP1A2GRM2GRM3SIGMAR1HPGD
SCHEMBL5110174 0.75 CHRM3 (0.49) CHRM2CHRM1
SCHEMBL2226760 0.74 CYP19A1 (0.31) SIGMAR1CHRM5CHRM2CHRM4CHRM1
SCHEMBL28827189 0.74 CYP1A2 (0.39) CYP1A2GRM2GRM3SIGMAR1HPGD
SCHEMBL4162513 0.73 CHRM3 (0.51) CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0435536-B1 Adhering an ink jet recording head using photopolymerisable adhesive CANON KK (JP) 1999-07-14 EP claimed
EP-0447590-B1 Liquid jet recording head and recording apparatus having same CANON KK (JP) 1994-08-24 EP claimed