SCHEMBL2869408

SCHEMBL2869408

CCCCCC(Cl)(Cl)c1ccccc1C(Cl)(Cl)CCCCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.37
SCN5A Q14524 3/20 0.33
SCN9A Q15858 3/20 0.33
HSP90AA1 P07900 2/20 0.33
LIPG Q9Y5X9 1/20 0.33
HSP90AB1 P08238 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
LTA4H P09960 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 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
SCHEMBL2875647 0.98 LIPG (0.36) GAASCN5ASCN9ALIPGCNR1
SCHEMBL2878742 0.98 LIPG (0.36) GAASCN5ASCN9ALIPGCNR1
SCHEMBL2880971 0.93 ESR1 (0.36) GAAHSP90AA1HSP90AB1LTA4HALDH1A1
SCHEMBL2875214 0.84 ESR1 (0.32) GAATP53TSHRALDH1A1CYP2C19
SCHEMBL6681462 0.84 KDM4E (0.37) GAACNR1CNR2MAPK1ALDH1A1
SCHEMBL6682626 0.82 KDM4E (0.38) GAACNR1CNR2MAPK1ALDH1A1
SCHEMBL6686907 0.82 KDM4E (0.38) GAACNR1CNR2MAPK1ALDH1A1
SCHEMBL6682657 0.81 TSHR (0.41) GAASCN5ASCN9AHSP90AA1SIGMAR1
SCHEMBL5586749 0.80 ALDH1A1 (0.39) CNR1CNR2ALDH1A1
SCHEMBL8673280 0.79 HSP90AA1 (0.41) GAASCN5ASCN9AHSP90AA1SIGMAR1

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