SCHEMBL2876018

SCHEMBL2876018

CCCCC(Br)(Br)c1ccccc1C(Br)(Br)CCCC

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.38
ESR2 Q92731 3/20 0.38
PCSK9 Q8NBP7 1/20 0.33
LTA4H P09960 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
KIF11 P52732 1/20 0.33
PTGS2 P35354 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
GAA P10253 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL2878770 0.93 GAA (0.38) LTA4HCYP1A2CYP2C19GAALMNA
SCHEMBL2876406 0.91 LIPG (0.37) CYP1A2CYP2C19GAALMNASMN1; SMN2
SCHEMBL2878195 0.91 LIPG (0.37) CYP1A2CYP2C19GAALMNASMN1; SMN2
SCHEMBL2875690 0.85 ESR1 (0.33) ESR1ESR2CYP2C19GAATDP1
SCHEMBL6680563 0.82 HTR1B (0.39) CYP1A2CYP2C19GAALMNASMN1; SMN2
SCHEMBL6686318 0.79 KIF11 (0.41) ESR1ESR2PCSK9LTA4HKIF11
SCHEMBL9751192 0.78 ALDH1A1 (0.44) TDP1
SCHEMBL5587928 0.78 IAPP (0.41) ESR1ESR2LMNATDP1
SCHEMBL3354286 0.77 TDP1 (0.37) ESR1ESR2PCSK9LTA4HKIF11
SCHEMBL6684254 0.77 KDM4E (0.38) CYP1A2CYP2C9CYP2C19GAALMNA

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-20100151392-A1 ANTIREFLECTIVE COATING COMPOSITIONS RAHMAN M DALIL 2010-06-17 US disclosed