SCHEMBL5822803

SCHEMBL5822803

CC(CC1CCC2OC2C1)c1cccc(Oc2cccc(C(C)CC3CCC4OC4C3)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 3/20 0.36
ACACB O00763 2/20 0.36
PTGS1 P23219 1/20 0.36
HTR1A P08908 2/20 0.35
HTR7 P34969 2/20 0.35
ALOX5 P09917 1/20 0.34
DRD2 P14416 1/20 0.34
ADRA1D P25100 1/20 0.34
HTR2A P28223 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
HTR6 P50406 1/20 0.34

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
SCHEMBL5817582 0.84 ACACA (0.34) ACACAACACB
SCHEMBL5822043 0.74 KDM4E (0.32) HTR2A
SCHEMBL18356791 0.69 ACHE (0.40)
SCHEMBL12852056 0.69 ALDH1A1 (0.49) ACACAACACB
SCHEMBL14397231 0.69 ALDH1A1 (0.49) ACACAACACB
SCHEMBL28194334 0.68 CPN1 (0.32)
SCHEMBL12032236 0.67 PIK3CD (0.32)
SCHEMBL5817830 0.67 GRM2 (0.44) DRD2
Hydrochloric Acid SCHEMBL11531847 0.67 PTGS1 (0.48) ACACAACACBPTGS1ALOX5
SCHEMBL5821283 0.66

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-1632794-A2 Radiation sensitive resin composition for forming microlens JSR Corporation (JP) 2006-03-08 EP disclosed
US-20060008735-A1 Radiation sensitive resin composition for forming microlens JSR CORPORATION (JP) 2006-01-12 US disclosed