SCHEMBL11810752

SCHEMBL11810752

CCc1ccc(-c2ccc3sc(-c4ccc(C)c(Cl)c4)cc3c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
AGTR1 P30556 1/20 0.36
ESR1 P03372 4/20 0.35
ESR2 Q92731 4/20 0.35
HDAC6 Q9UBN7 4/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
FDPS P14324 4/20 0.35
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
PIM1 P11309 1/20 0.33
PIM3 Q86V86 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
DHODH Q02127 1/20 0.33
IKBKB O14920 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
SCHEMBL1622230 0.81 MAPT (0.48) GAAMAPTAGTR1KDM4E
SCHEMBL11810763 0.80 KDM4E (0.35) GAAMAPTESR1ESR2HDAC6
SCHEMBL3627201 0.73 ESR1 (0.46) GAAMAPTESR1ESR2HDAC6
SCHEMBL13766429 0.69 APP (0.62) MAPTESR1ESR2SMN1; SMN2IKBKB
SCHEMBL18724120 0.68 PDE3B (0.40) GAAMAPTAGTR1
SCHEMBL10332042 0.68 GRIN2B (0.38) MAPTFDPSKDM4EDHODH
SCHEMBL12603805 0.68 AHR (0.61)
SCHEMBL22296375 0.67 BCL2 (0.50) GAAMAPTAGTR1ESR2KDM4E
SCHEMBL1755262 0.67 MAPT (0.49) GAAMAPTAGTR1KDM4E
SCHEMBL12259927 0.67 CYP3A4 (0.56) MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3993645-A Stilbene optical brighteners and compositions brightened therewith STERLING DRUG INC. (US) 1976-11-23 US disclosed
US-3974144-A BENZOFURAN, BENZOTHIOPHENE, NAPHTHOFURAN, OPTICAL BRIGHTENER STERLING DRUG INC. (US) 1976-08-10 US disclosed
US-3932301-A NYLON, POLYESTERS STERLING DRUG INC. (US) 1976-01-13 US disclosed