SCHEMBL9011114

SCHEMBL9011114

CCCCC(CC)CC1(CC(CC)CCCC)CCCCC1(CO)CO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
CA2 P00918 2/20 0.40
TDP1 Q9NUW8 2/20 0.38
CYP3A4 P08684 4/20 0.37
TSHR P16473 3/20 0.37
LMNA P02545 1/20 0.34
CHRM2 P08172 1/20 0.34
HTR1A P08908 1/20 0.34
ADRA2A P08913 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
CHRM1 P11229 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
OPRM1 P35372 1/20 0.34
DRD3 P35462 1/20 0.34
SLC6A3 Q01959 1/20 0.34
KCNH2 Q12809 1/20 0.34
CYP2D6 P10635 1/20 0.34
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL2422013 0.87 ALDH1A1 (0.45) ALDH1A1CA2TDP1CYP3A4TSHR
SCHEMBL2233956 0.78 CA2 (0.39) ALDH1A1CA2TDP1CYP3A4TSHR
SCHEMBL574963 0.76 ALDH1A1 (0.45) ALDH1A1CA2TDP1CYP3A4TSHR
SCHEMBL364922 0.74 ALDH1A1 (0.43) ALDH1A1CA2TDP1CYP3A4TSHR
SCHEMBL5342464 0.72 LMNA (0.45) TSHRLMNAOPRM1
SCHEMBL30419897 0.71 ALDH1A1 (0.41) ALDH1A1CA2TDP1CYP3A4TSHR
SCHEMBL2861074 0.71 ALDH1A1 (0.45) ALDH1A1CA2TDP1CYP3A4TSHR
SCHEMBL3360175 0.71 CA2 (0.42) ALDH1A1CA2TDP1CYP3A4TSHR
SCHEMBL21244362 0.70 ALDH1A1 (0.39) ALDH1A1CA2TDP1CYP3A4TSHR
SCHEMBL16908421 0.70 CYP2C19 (0.42) ALDH1A1CA2TDP1CYP3A4TSHR

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-0742479-A2 Lubricant particles, method of preparation, and photographic elements EASTMAN KODAK COMPANY (US) 1996-11-13 EP disclosed
US-5541048-A Lubricant particles, method of preparation, and photographic elements EASTMAN KODAK COMPANY (US) 1996-07-30 US disclosed