SCHEMBL11069560

SCHEMBL11069560

OCCOc1cc(Cl)c(OCCO)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
LMNA P02545 2/20 0.44
NR1I2 O75469 1/20 0.41
ADRA2A P08913 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
TACR2 P21452 1/20 0.41
DRD1 P21728 1/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
ADORA1 P30542 1/20 0.41
SLC6A4 P31645 1/20 0.41
OPRM1 P35372 1/20 0.41
DRD3 P35462 1/20 0.41
OPRK1 P41145 1/20 0.41
HTR6 P50406 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KCNH2 Q12809 1/20 0.41

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
SCHEMBL134595 0.95 LMNA (0.48) ALDH1A1LMNANR1I2ADRA2AADORA3
SCHEMBL29444902 0.95 LMNA (0.48) ALDH1A1LMNANR1I2ADRA2AADORA3
SCHEMBL4897444 0.95 LMNA (0.48) ALDH1A1LMNANR1I2ADRA2AADORA3
SCHEMBL11707698 0.88 GAA (0.46) ALDH1A1LMNAIDO1LOXAOC3
SCHEMBL10358917 0.82 MAPT (0.65) ALDH1A1LMNAL3MBTL1MAPK1POLB
SCHEMBL4334537 0.81 S1PR4 (0.61) L3MBTL1MAPK1MAPTHPGDNPSR1
SCHEMBL10359297 0.81 ALDH1A1 (0.68) ALDH1A1LMNAL3MBTL1MAPK1POLB
SCHEMBL21477276 0.79 ALDH1A1 (0.49) ALDH1A1LMNAL3MBTL1MAPK1POLB
SCHEMBL9503538 0.79 SMN1; SMN2 (0.50) ALDH1A1NR1I2L3MBTL1MAPK1MAPT
SCHEMBL10889603 0.79 GAA (0.41) ALDH1A1LMNAL3MBTL1MEN1USP2

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-4468510-A FILMS, FIBERS, MOLDING PLASTICS, LOW GAS PERMEABILITY EASTMAN KODAK COMPANY (US) 1984-08-28 US disclosed